Compound Name

SMILES String

Fc1cc(F)cc(c1)N1CCC[C@@H]1c1cc(cc2c1oc(cc2=O)N1CCOCC1)C(=O)N1CCOCC1 |r|

C[N+](C)=c1ccn(Cc2ccc(CCCCc3ccc(Cn4ccc(cc4)=[N+](C)C)cc3)cc2)cc1 |(16.16,-7.42,;16.14,-5.88,;17.47,-5.1,;14.79,-5.13,;13.47,-5.91,;12.13,-5.16,;12.12,-3.62,;10.78,-2.86,;9.45,-3.65,;9.46,-5.18,;8.14,-5.95,;6.81,-5.2,;5.48,-5.98,;4.15,-5.21,;2.82,-5.99,;1.48,-5.22,;.15,-6,;.15,-7.55,;-1.19,-8.32,;-2.52,-7.55,;-3.86,-8.32,;-5.19,-7.55,;-5.18,-6,;-6.52,-5.24,;-7.85,-6,;-7.84,-7.55,;-6.52,-8.32,;-9.18,-5.24,;-9.18,-3.7,;-10.52,-6,;-2.52,-6,;-1.19,-5.23,;6.79,-3.67,;8.1,-2.89,;13.43,-2.83,;14.77,-3.58,)|

CN(c1ccc(Cl)cc1)c1cc[n+](Cc2ccc(OCCOc3ccc(C[n+]4ccc(N(C)c5ccc(Cl)cc5)c5ccc(Cl)cc45)cc3)cc2)c2cc(Cl)ccc12

OC1C[N+]2(Cc3ccc(OCCOc4ccc(C[N+]56CCC(CC5)C(O)C6)cc4)cc3)CCC1CC2

C\[N+](c1ccc(Cl)cc1)=c1\ccn(Cc2ccc(cc2)-c2ccc(Cn3cc\c(=[N+](/C)c4ccc(Cl)cc4)c4ccccc34)cc2)c2ccccc12

Clc1ccc2c(cc[n+](Cc3ccc(OCCOc4ccc(C[n+]5ccc(N6CCCC6)c6ccc(Cl)cc56)cc4)cc3)c2c1)N1CCCC1

Clc1ccc2c(cc[n+](Cc3ccc(OCCOc4ccc(C[n+]5ccc(N6CCCCCC6)c6ccc(Cl)cc56)cc4)cc3)c2c1)N1CCCCCC1

C(COc1ccc(C[n+]2ccc(N3CCCCCC3)c3ccccc23)cc1)Oc1ccc(C[n+]2ccc(N3CCCCCC3)c3ccccc23)cc1

CN(c1ccccc1)c1cc[n+](Cc2ccc(OCCOc3ccc(C[n+]4ccc(N(C)c5ccccc5)c5ccc(Cl)cc45)cc3)cc2)c2cc(Cl)ccc12

CN(c1ccc(Cl)cc1)c1cc[n+](Cc2ccc(OCCOc3ccc(C[n+]4ccc(N(C)c5ccc(Cl)cc5)c5ccccc45)cc3)cc2)c2ccccc12

CN(c1ccccc1)c1cc[n+](Cc2ccc(OCCOc3ccc(C[n+]4ccc(N(C)c5ccccc5)c5ccccc45)cc3)cc2)c2ccccc12

C(COc1ccc(C[N+]23CCC(CC2)CC3)cc1)Oc1ccc(C[N+]23CCC(CC2)CC3)cc1

CN(c1ccc(Cl)cc1)c1cc[n+](Cc2ccc(OCCOc3ccc(C[n+]4ccc(cc4)N(C)c4ccc(Cl)cc4)cc3)cc2)cc1

C(COc1ccc(C[n+]2ccc(cc2)N2CCCC2)cc1)Oc1ccc(C[n+]2ccc(cc2)N2CCCC2)cc1

CN(C)c1cc[n+](cc1)Cc2ccc(cc2)OCCOc3ccc(cc3)C[n+]4ccc(cc4)N(C)C

O=C(Cc1cccc(OCCCN2CCNCC2)c1)Nc1nc(cs1)-c1ccncc1

CS(=O)(=O)Nc1cccc(CC(=O)Nc2nc(cs2)-c2c[nH]c3ncccc23)c1

O=C(Cc1cccc(OCCCC2CCNCC2)c1)Nc1nc(cs1)-c1c[nH]c2ncccc12

CN(C)c1cc[n+](CCCCCCCCCCCC[n+]2ccc(cc2)N(C)C)cc1

CN(C)c1cc[n+](CCCCCCCCCCCCCC[n+]2ccc(cc2)N(C)C)cc1

[NH2+]=c1ccn(Cc2ccc(CCc3ccc(Cn4ccc(=[NH2+])cc4)cc3)cc2)cc1

N#Cc1cc[n+](Cc2ccc(CCc3ccc(C[n+]4ccc(cc4)C#N)cc3)cc2)cc1

C=CC[N+](CC=C)=c1ccn(Cc2ccc(CCc3ccc(Cn4ccc(cc4)=[N+](CC=C)CC=C)cc3)cc2)cc1 |(22.24,-10.18,;22.22,-8.64,;20.88,-7.87,;20.87,-6.33,;22.2,-5.56,;23.54,-6.32,;24.87,-5.54,;19.54,-5.58,;18.21,-6.35,;16.87,-5.58,;16.85,-4.04,;15.52,-3.29,;14.19,-4.07,;14.19,-5.61,;12.86,-6.38,;11.53,-5.61,;10.2,-6.38,;8.87,-5.62,;7.54,-6.4,;6.21,-5.63,;4.88,-6.4,;4.88,-7.94,;3.53,-8.71,;2.2,-7.94,;2.22,-6.4,;.89,-5.63,;-.46,-6.4,;-.44,-7.94,;.89,-8.71,;-1.79,-5.63,;-3.12,-6.4,;-4.45,-5.63,;-5.79,-6.4,;-1.79,-4.09,;-3.12,-3.32,;-3.12,-1.78,;6.21,-8.71,;7.54,-7.94,;11.53,-4.08,;12.86,-3.3,;18.18,-3.27,;19.51,-4.02,)|

C(Cc1ccc(Cn2ccc(cc2)=[N+]2CCCCC2)cc1)c1ccc(Cn2ccc(cc2)=[N+]2CCCCC2)cc1 |(8.87,-5.62,;10.2,-6.38,;11.53,-5.61,;12.86,-6.38,;14.19,-5.61,;14.19,-4.07,;15.52,-3.29,;16.85,-4.04,;16.87,-5.58,;18.21,-6.35,;19.54,-5.58,;19.51,-4.02,;18.18,-3.27,;20.87,-6.33,;22.2,-5.55,;23.53,-6.32,;23.54,-7.86,;22.2,-8.64,;20.87,-7.87,;12.86,-3.3,;11.53,-4.08,;7.54,-6.4,;6.21,-5.63,;4.88,-6.4,;4.88,-7.94,;3.53,-8.71,;2.2,-7.94,;2.22,-6.4,;.89,-5.63,;-.46,-6.4,;-.44,-7.94,;.89,-8.71,;-1.79,-5.63,;-1.79,-4.09,;-3.12,-3.32,;-4.45,-4.09,;-4.46,-5.63,;-3.12,-6.4,;6.21,-8.71,;7.54,-7.94,)|

C[N+](C)=c1ccn(Cc2ccc(CCc3ccc(Cn4ccc(cc4)=[N+](C)C)cc3)cc2)cc1 |(20.93,-7.34,;20.91,-5.8,;22.24,-5.01,;19.58,-5.03,;18.25,-5.81,;16.9,-5.05,;16.89,-3.51,;15.56,-2.74,;14.22,-3.52,;14.22,-5.06,;12.89,-5.85,;11.56,-5.07,;10.23,-5.85,;8.89,-5.08,;7.56,-5.85,;6.22,-5.08,;4.89,-5.87,;4.89,-7.41,;3.54,-8.18,;2.21,-7.41,;2.22,-5.87,;.89,-5.1,;-.46,-5.87,;-.44,-7.42,;.89,-8.18,;-1.79,-5.1,;-3.13,-5.87,;-1.79,-3.55,;6.22,-8.18,;7.56,-7.41,;11.55,-3.54,;12.88,-2.76,;18.22,-2.72,;19.56,-3.48,)|

OCc1cc[n+](Cc2ccc(CCc3ccc(C[n+]4ccc(CO)cc4)cc3)cc2)cc1

OC(=O)c1cc[n+](Cc2ccc(CCc3ccc(C[n+]4ccc(cc4)C(O)=O)cc3)cc2)cc1

C(Cc1ccc(Cn2ccc(cc2)=[N+]2CCCC2)cc1)c1ccc(Cn2ccc(cc2)=[N+]2CCCC2)cc1 |(8.87,-5.62,;10.2,-6.38,;11.53,-5.61,;12.86,-6.38,;14.19,-5.61,;14.19,-4.07,;15.52,-3.29,;16.85,-4.04,;16.87,-5.58,;18.21,-6.35,;19.54,-5.58,;19.51,-4.02,;18.18,-3.27,;20.87,-6.33,;22.28,-5.7,;23.32,-6.84,;22.55,-8.17,;21.05,-7.86,;12.86,-3.3,;11.53,-4.08,;7.54,-6.4,;6.21,-5.63,;4.88,-6.4,;4.88,-7.94,;3.53,-8.71,;2.2,-7.94,;2.22,-6.4,;.89,-5.63,;-.46,-6.4,;-.44,-7.94,;.89,-8.71,;-1.79,-5.63,;-1.95,-4.09,;-3.45,-3.78,;-4.22,-5.11,;-3.19,-6.25,;6.21,-8.71,;7.54,-7.94,)|

Cc1cc[n+](Cc2ccc(CCc3ccc(C[n+]4ccc(C)cc4)cc3)cc2)cc1

C(Cc1ccc(Cn2ccc(cc2)=[N+]2CCCCCC2)cc1)c1ccc(Cn2ccc(cc2)=[N+]2CCCCCC2)cc1 |(8.88,-5.63,;10.21,-6.38,;11.54,-5.61,;12.87,-6.38,;14.2,-5.61,;14.2,-4.07,;15.53,-3.29,;16.86,-4.05,;16.88,-5.59,;18.22,-6.36,;19.55,-5.58,;19.53,-4.02,;18.19,-3.28,;20.88,-6.33,;20.78,-7.88,;21.91,-8.92,;23.44,-8.67,;24.19,-7.33,;23.61,-5.91,;22.14,-5.46,;12.86,-3.3,;11.53,-4.09,;7.55,-6.4,;6.21,-5.63,;4.88,-6.4,;4.88,-7.95,;3.53,-8.72,;2.2,-7.95,;2.22,-6.4,;.89,-5.63,;-.46,-6.4,;-.44,-7.95,;.89,-8.72,;-1.79,-5.63,;-1.67,-4.09,;-2.82,-3.04,;-4.33,-3.29,;-5.11,-4.62,;-4.54,-6.05,;-3.06,-6.5,;6.21,-8.72,;7.55,-7.95,)|

COc1ncc(cc1NS(C)(=O)=O)-c1cc2COCc2c(NC(=O)CN2CCOCC2)c1

CN(C)c1cc[n+](cc1)Cc2ccccc2

C(c1ccccc1)n1ccc(cc1)=[N+]1CCCC1 |(1.13,-28.27,;2.46,-27.5,;3.79,-28.27,;5.12,-27.5,;5.12,-25.96,;3.78,-25.19,;2.45,-25.97,;-.2,-27.51,;-1.54,-28.28,;-2.87,-27.51,;-2.87,-25.96,;-1.54,-25.19,;-.21,-25.96,;-4.21,-25.19,;-4.37,-23.65,;-5.88,-23.33,;-6.65,-24.67,;-5.61,-25.81,)|

Clc1ccc2c(cc[n+](Cc3ccccc3)c2c1)N1CCCCCC1

CN(c1ccccc1)c1cc[n+](Cc2ccccc2)c2cc(Cl)ccc12

CN(C)c1cc[n+](Cc2ccc(cc2)-c2ccccc2)cc1

C(c1ccc(cc1)-c1ccccc1)[n+]1ccc(cc1)N1CCCC1

Clc1ccc2c(cc[n+](Cc3ccc(cc3)-c3ccccc3)c2c1)N1CCCCCC1

CN(c1ccccc1)c1cc[n+](Cc2ccc(cc2)-c2ccccc2)c2cc(Cl)ccc12

CN(C)c1ccncc1

C1CCN(C1)c1ccncc1

Clc1ccc2c(ccnc2c1)N1CCCCCC1

CN(c1ccccc1)c1ccnc2cc(Cl)ccc12

C1N[c+]2ccn(Cc3cccc(Cn4cc[c+](NCc5ccc1cc5)cc4)c3)cc2

C1N[c+]2ccn(Cc3ccc(Cn4cc[c+](NCc5ccc1cc5)cc4)cc3)cc2

C1N[c+]2ccn(Cc3cccc(Cn4cc[c+](NCc5cccc1c5)cc4)c3)cc2

C1N[c+]2ccn(Cc3ccc(Cn4cc[c+](NCc5cccc1c5)cc4)cc3)cc2

C[N+](c1ccc(Cl)cc1)=c1ccn(Cc2cc(Cn3ccc(cc3)=[N+](C)c3ccc(Cl)cc3)cc(Cn3ccc(cc3)=[N+](C)c3ccc(Cl)cc3)c2)cc1 |(12.25,-15.06,;10.9,-14.29,;9.57,-15.06,;9.6,-16.6,;8.27,-17.37,;6.94,-16.61,;5.61,-17.39,;6.93,-15.07,;8.24,-14.3,;10.9,-12.75,;12.23,-11.98,;12.23,-10.44,;10.9,-9.68,;10.9,-8.14,;12.23,-7.36,;13.56,-8.13,;14.91,-7.36,;16.25,-8.12,;16.25,-9.66,;17.58,-10.41,;17.6,-11.95,;16.27,-12.72,;14.92,-11.97,;14.92,-10.43,;16.27,-14.26,;14.96,-15.06,;17.62,-15.03,;17.62,-16.59,;18.97,-17.34,;20.31,-16.57,;21.64,-17.34,;20.28,-15.01,;18.93,-14.26,;14.89,-5.82,;13.56,-5.06,;13.56,-3.52,;12.23,-2.75,;10.88,-3.52,;9.55,-2.75,;9.55,-1.21,;10.88,-.43,;12.23,-1.2,;8.22,-.44,;8.22,1.1,;6.89,-1.21,;5.56,-.44,;4.21,-1.21,;4.21,-2.75,;2.89,-3.52,;5.56,-3.52,;6.89,-2.74,;12.23,-5.83,;9.57,-10.44,;9.57,-11.98,)|

c1cc(ccc1NC(=O)C2CCC(CC2)n3cnc4c3ncnc4N)S(=O)(=O)C(F)(F)F

Nc1ncnc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1cccc(c1)S(=O)(=O)C(F)(F)F |r,wU:10.11,13.18,(37.09,-3.67,;37.1,-5.21,;38.44,-5.97,;38.44,-7.52,;37.1,-8.29,;35.77,-7.52,;34.3,-8,;33.4,-6.75,;34.31,-5.51,;35.77,-5.98,;33.83,-9.46,;32.32,-9.77,;31.84,-11.23,;32.86,-12.38,;34.37,-12.07,;34.86,-10.6,;32.38,-13.84,;33.4,-14.99,;30.87,-14.16,;29.85,-13.01,;30.33,-11.55,;29.31,-10.4,;27.8,-10.71,;27.32,-12.18,;28.35,-13.33,;25.8,-12.5,;26.2,-13.99,;24.71,-13.59,;24.78,-11.35,;23.27,-11.67,;25.26,-9.89,;23.68,-10.25,)|

Nc1ncnc2n(C[C@H]3CC[C@H](CC3)C(=O)Nc3ccc(cc3)S(=O)(=O)C(F)(F)F)cnc12 |r,wU:11.14,8.7,(59.12,-6.53,;59.13,-8.07,;60.46,-8.83,;60.47,-10.38,;59.13,-11.15,;57.79,-10.38,;56.33,-10.86,;55.85,-12.32,;54.37,-12.73,;53.99,-14.21,;52.49,-14.61,;51.4,-13.53,;51.8,-12.04,;53.28,-11.64,;49.91,-13.93,;49.52,-15.41,;48.82,-12.84,;49.22,-11.35,;50.71,-10.96,;51.1,-9.47,;50.01,-8.38,;48.52,-8.79,;48.13,-10.27,;50.41,-6.89,;51.43,-5.73,;51.93,-7.19,;49.04,-6.19,;47.74,-7.02,;48.96,-4.65,;47.66,-5.49,;55.43,-9.61,;56.33,-8.37,;57.8,-8.84,)|

Nc1ncnc2n(C[C@H]3CC[C@H](CC3)C(=O)Nc3cccc(c3)S(=O)(=O)C(F)(F)F)cnc12 |r,wU:11.14,8.7,(79.98,-6.39,;79.98,-7.93,;81.32,-8.7,;81.32,-10.25,;79.99,-11.02,;78.65,-10.25,;77.19,-10.72,;76.71,-12.19,;75.22,-12.59,;74.84,-14.08,;73.35,-14.48,;72.26,-13.39,;72.66,-11.9,;74.14,-11.5,;70.77,-13.79,;70.37,-15.28,;69.68,-12.7,;70.08,-11.22,;71.56,-10.82,;71.96,-9.34,;70.87,-8.25,;69.38,-8.65,;68.99,-10.14,;68.28,-7.57,;67.5,-8.9,;66.74,-7.56,;68.68,-6.08,;67.58,-5,;70.16,-5.68,;69.07,-4.58,;76.29,-9.48,;77.19,-8.23,;78.65,-8.71,)|

Nc1ncnc2n(Cc3ccc(cc3)C(=O)Nc3ccc(cc3)S(=O)(=O)C(F)(F)F)cnc12

Nc1ncnc2n(Cc3ccc(cc3)C(=O)Nc3cccc(c3)S(=O)(=O)C(F)(F)F)cnc12

Nc1nc(Cl)nc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1ccc(cc1)S(=O)(=O)C(F)(F)F |r,wU:11.12,14.19,(57.56,-20.97,;57.57,-22.51,;58.91,-23.27,;58.91,-24.82,;60.25,-25.59,;57.57,-25.6,;56.24,-24.83,;54.77,-25.3,;53.87,-24.05,;54.78,-22.81,;56.24,-23.29,;54.29,-26.76,;52.79,-27.07,;52.31,-28.53,;53.33,-29.68,;54.84,-29.37,;55.33,-27.9,;52.85,-31.15,;53.87,-32.3,;51.34,-31.46,;50.31,-30.31,;50.8,-28.85,;49.78,-27.7,;48.27,-28.01,;47.79,-29.49,;48.81,-30.63,;47.24,-26.86,;46.83,-25.37,;48.33,-25.76,;45.9,-27.62,;45.89,-29.16,;44.57,-26.84,;44.56,-28.39,)|

CS(=O)(=O)c1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)ncnc23)cc1 |r,wU:14.17,11.10,(67.97,-27.27,;69.31,-26.51,;68.9,-25.02,;70.4,-25.41,;70.34,-27.66,;71.85,-27.35,;72.87,-28.5,;72.38,-29.96,;73.41,-31.11,;74.92,-30.8,;75.94,-31.95,;75.4,-29.33,;74.38,-28.18,;74.86,-26.72,;76.37,-26.42,;77.4,-27.55,;76.91,-29.02,;76.84,-24.95,;75.94,-23.7,;76.85,-22.46,;78.31,-22.94,;79.64,-22.16,;79.63,-20.62,;80.98,-22.92,;80.98,-24.48,;79.64,-25.25,;78.31,-24.48,;70.88,-30.28,;69.86,-29.14,)|

CS(=O)(=O)c1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)ncnc23)c1 |r,wU:15.18,12.11,(2.36,-41.83,;3.39,-42.98,;3.78,-44.47,;2.3,-44.07,;4.9,-42.66,;5.38,-41.19,;6.89,-40.88,;7.92,-42.03,;7.43,-43.49,;8.45,-44.64,;9.96,-44.32,;10.99,-45.48,;10.45,-42.86,;9.42,-41.71,;9.9,-40.25,;11.41,-39.94,;12.44,-41.08,;11.96,-42.55,;11.89,-38.48,;10.98,-37.23,;11.89,-35.99,;13.35,-36.46,;14.68,-35.69,;14.68,-34.15,;16.02,-36.45,;16.03,-38,;14.69,-38.78,;13.35,-38,;5.93,-43.81,)|

Nc1ncnc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1ccncc1 |r,wU:10.11,13.18,(29.63,-34.62,;29.63,-36.16,;30.97,-36.92,;30.97,-38.48,;29.64,-39.25,;28.3,-38.48,;26.83,-38.95,;25.93,-37.7,;26.84,-36.46,;28.3,-36.94,;26.36,-40.41,;24.85,-40.72,;24.37,-42.18,;25.39,-43.33,;26.9,-43.02,;27.39,-41.55,;24.91,-44.8,;25.94,-45.95,;23.4,-45.11,;22.38,-43.96,;22.86,-42.5,;21.84,-41.35,;20.33,-41.66,;19.85,-43.14,;20.87,-44.28,)|

Nc1ncnc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1cccnc1 |r,wU:10.11,13.18,(46.3,-36.42,;46.31,-37.96,;47.65,-38.72,;47.65,-40.28,;46.31,-41.05,;44.98,-40.28,;43.51,-40.75,;42.61,-39.5,;43.52,-38.26,;44.98,-38.74,;43.03,-42.22,;41.53,-42.52,;41.05,-43.98,;42.07,-45.13,;43.58,-44.82,;44.07,-43.35,;41.59,-46.6,;42.61,-47.75,;40.08,-46.91,;39.05,-45.76,;39.54,-44.3,;38.52,-43.15,;37.01,-43.46,;36.53,-44.94,;37.55,-46.08,)|

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)ncnc23)cc1 |r,wU:12.15,9.8,(51.63,-41.79,;51.15,-43.26,;52.18,-44.41,;53.69,-44.1,;54.71,-45.25,;54.22,-46.7,;55.25,-47.85,;56.76,-47.54,;57.78,-48.69,;57.24,-46.08,;56.22,-44.92,;56.7,-43.47,;58.21,-43.16,;59.24,-44.29,;58.75,-45.76,;58.68,-41.69,;57.78,-40.45,;58.69,-39.2,;60.15,-39.68,;61.48,-38.9,;61.47,-37.36,;62.82,-39.67,;62.82,-41.22,;61.48,-41.99,;60.15,-41.22,;52.72,-47.02,;51.7,-45.88,)|

COc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)ncnc23)c1 |r,wU:10.9,13.16,(19.17,-18.87,;20.21,-20.01,;21.71,-19.69,;22.19,-18.22,;23.7,-17.9,;24.73,-19.05,;24.24,-20.51,;25.27,-21.66,;26.78,-21.34,;27.81,-22.5,;27.26,-19.88,;26.24,-18.73,;26.72,-17.27,;28.23,-16.96,;29.27,-18.1,;28.77,-19.57,;28.7,-15.5,;27.81,-14.25,;28.71,-13,;30.18,-13.48,;31.51,-12.7,;31.5,-11.16,;32.84,-13.47,;32.85,-15.02,;31.51,-15.79,;30.18,-15.02,;22.74,-20.83,)|

COc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(Cl)nc23)c1 |r,wU:13.16,10.9,(1.96,-10.48,;2.99,-11.63,;4.5,-11.31,;4.98,-9.84,;6.49,-9.53,;7.51,-10.68,;7.02,-12.13,;8.05,-13.28,;9.56,-12.97,;10.58,-14.12,;10.04,-11.51,;9.02,-10.36,;9.5,-8.9,;11,-8.59,;12.04,-9.73,;11.55,-11.19,;11.48,-7.13,;10.58,-5.88,;11.49,-4.63,;12.95,-5.11,;14.28,-4.33,;14.27,-2.79,;15.62,-5.1,;15.62,-6.65,;16.96,-7.42,;14.28,-7.42,;12.95,-6.65,;5.52,-12.45,)|

COc1ccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(Cl)nc23)cc1OC |r,wU:12.15,9.8,(23.03,-8.38,;22.55,-9.84,;23.57,-10.99,;25.08,-10.68,;26.11,-11.83,;25.62,-13.29,;26.64,-14.44,;28.15,-14.12,;29.18,-15.27,;28.64,-12.66,;27.61,-11.51,;28.09,-10.05,;29.6,-9.74,;30.63,-10.88,;30.15,-12.35,;30.08,-8.28,;29.17,-7.03,;30.08,-5.79,;31.54,-6.26,;32.87,-5.49,;32.87,-3.95,;34.21,-6.25,;34.22,-7.8,;35.55,-8.57,;32.88,-8.57,;31.54,-7.8,;24.12,-13.61,;23.09,-12.46,;21.58,-12.78,;20.55,-11.63,)|

COc1cccc(CNC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(Cl)nc23)c1 |r,wU:14.17,11.10,(38.69,-16.37,;40.2,-16.04,;40.67,-14.57,;39.63,-13.43,;40.1,-11.97,;41.6,-11.65,;42.62,-12.79,;44.12,-12.47,;45.15,-13.62,;46.66,-13.31,;47.68,-14.46,;47.14,-11.84,;46.12,-10.69,;46.6,-9.23,;48.1,-8.93,;49.14,-10.06,;48.65,-11.53,;48.58,-7.46,;47.68,-6.21,;48.59,-4.97,;50.05,-5.45,;51.38,-4.67,;51.37,-3.13,;52.72,-5.43,;52.72,-6.99,;54.06,-7.75,;51.38,-7.76,;50.05,-6.99,;42.16,-14.24,)|

COc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(nc23)-c2cccc(O)c2)c1 |r,wU:13.16,10.9,(59.14,-11.11,;60.17,-12.25,;61.68,-11.93,;62.16,-10.46,;63.67,-10.15,;64.7,-11.3,;64.21,-12.76,;65.23,-13.91,;66.74,-13.6,;67.77,-14.75,;67.23,-12.13,;66.2,-10.98,;66.68,-9.52,;68.19,-9.21,;69.22,-10.35,;68.74,-11.82,;68.67,-7.75,;67.76,-6.5,;68.67,-5.26,;70.13,-5.73,;71.46,-4.96,;71.46,-3.42,;72.8,-5.72,;72.81,-7.27,;71.47,-8.05,;70.13,-7.27,;74.13,-8.04,;74.13,-9.58,;75.47,-10.35,;76.8,-9.58,;76.8,-8.03,;78.13,-7.25,;75.46,-7.27,;62.71,-13.08,)|

COc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(nc23)-c2ccc(O)cc2)c1 |r,wU:13.16,10.9,(3.98,-28.74,;5.01,-29.89,;6.52,-29.57,;7,-28.1,;8.51,-27.79,;9.54,-28.94,;9.05,-30.39,;10.07,-31.55,;11.58,-31.23,;12.61,-32.38,;12.07,-29.77,;11.04,-28.62,;11.52,-27.16,;13.03,-26.85,;14.06,-27.99,;13.58,-29.45,;13.51,-25.39,;12.6,-24.14,;13.51,-22.89,;14.97,-23.37,;16.3,-22.6,;16.3,-21.05,;17.64,-23.36,;17.65,-24.91,;16.31,-25.68,;14.97,-24.91,;18.97,-25.68,;18.97,-27.22,;20.31,-27.99,;21.64,-27.22,;22.98,-27.98,;21.64,-25.67,;20.3,-24.91,;7.55,-30.72,)|

COc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(nc23)-c2cccnc2)c1 |r,wU:13.16,10.9,(23.3,-29.97,;24.33,-31.11,;25.84,-30.79,;26.32,-29.32,;27.83,-29.01,;28.86,-30.16,;28.37,-31.62,;29.39,-32.77,;30.9,-32.46,;31.93,-33.61,;31.39,-30.99,;30.36,-29.84,;30.84,-28.38,;32.35,-28.07,;33.38,-29.21,;32.9,-30.68,;32.83,-26.61,;31.92,-25.36,;32.83,-24.12,;34.29,-24.6,;35.62,-23.82,;35.62,-22.28,;36.96,-24.58,;36.96,-26.13,;35.63,-26.91,;34.29,-26.13,;38.29,-26.9,;38.29,-28.44,;39.63,-29.21,;40.96,-28.44,;40.96,-26.89,;39.62,-26.13,;26.87,-31.94,)|

COc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(nc23)-c2ccncc2)c1 |r,wU:13.16,10.9,(43.61,-29.56,;44.64,-30.71,;46.15,-30.39,;46.63,-28.92,;48.14,-28.61,;49.17,-29.76,;48.68,-31.21,;49.7,-32.36,;51.21,-32.05,;52.24,-33.2,;51.7,-30.59,;50.67,-29.44,;51.15,-27.98,;52.66,-27.67,;53.69,-28.81,;53.21,-30.27,;53.14,-26.2,;52.23,-24.96,;53.14,-23.71,;54.6,-24.19,;55.93,-23.41,;55.93,-21.87,;57.27,-24.18,;57.28,-25.73,;55.94,-26.5,;54.6,-25.73,;58.61,-26.5,;58.6,-28.04,;59.94,-28.81,;61.27,-28.04,;61.27,-26.49,;59.93,-25.73,;47.18,-31.54,)|

COc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(nc23)-c2cc[nH]n2)c1 |r,wU:13.16,10.9,(66.29,-30.19,;67.32,-31.33,;68.83,-31.02,;69.31,-29.54,;70.82,-29.23,;71.84,-30.38,;71.35,-31.84,;72.38,-32.99,;73.89,-32.68,;74.91,-33.83,;74.37,-31.21,;73.35,-30.06,;73.83,-28.6,;75.33,-28.3,;76.37,-29.43,;75.88,-30.9,;75.81,-26.83,;74.91,-25.59,;75.82,-24.34,;77.28,-24.82,;78.61,-24.04,;78.6,-22.5,;79.94,-24.81,;79.95,-26.36,;78.61,-27.13,;77.28,-26.36,;81.29,-27.12,;81.45,-28.65,;82.96,-28.97,;83.72,-27.64,;82.69,-26.49,;69.85,-32.16,)|

COc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(nc23)-c2cccc(c2)C(N)=O)c1 |r,wU:13.16,10.9,(-1.11,-49.59,;-.08,-50.73,;1.44,-50.41,;1.92,-48.94,;3.43,-48.63,;4.45,-49.78,;3.96,-51.24,;4.99,-52.39,;6.5,-52.08,;7.52,-53.23,;6.98,-50.61,;5.96,-49.46,;6.44,-48,;7.94,-47.69,;8.98,-48.83,;8.49,-50.3,;8.42,-46.23,;7.52,-44.98,;8.43,-43.74,;9.89,-44.22,;11.22,-43.44,;11.21,-41.9,;12.56,-44.2,;12.56,-45.75,;11.22,-46.53,;9.89,-45.76,;13.89,-46.52,;13.89,-48.06,;15.22,-48.83,;16.56,-48.06,;16.55,-46.51,;15.22,-45.75,;17.88,-45.73,;19.22,-46.5,;17.88,-44.19,;2.46,-51.56,)|

COc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(nc23)-c2cccc(NC=O)c2)c1 |r,wU:13.16,10.9,(17.64,-50.29,;18.67,-51.43,;20.18,-51.12,;20.66,-49.64,;22.17,-49.33,;23.2,-50.48,;22.71,-51.94,;23.73,-53.09,;25.24,-52.78,;26.27,-53.93,;25.72,-51.31,;24.7,-50.16,;25.18,-48.7,;26.69,-48.39,;27.72,-49.53,;27.24,-51,;27.17,-46.93,;26.26,-45.68,;27.17,-44.44,;28.63,-44.92,;29.96,-44.14,;29.96,-42.6,;31.3,-44.9,;31.3,-46.46,;29.97,-47.23,;28.63,-46.46,;32.63,-47.22,;32.63,-48.77,;33.97,-49.53,;35.3,-48.76,;35.3,-47.21,;36.63,-46.43,;37.96,-47.2,;39.3,-46.42,;33.96,-46.45,;21.21,-52.26,)|

COc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(nc23)-c2cccc(N)c2)c1 |r,wU:13.16,10.9,(41.98,-50.23,;43.01,-51.38,;44.51,-51.06,;44.99,-49.59,;46.51,-49.28,;47.53,-50.43,;47.04,-51.89,;48.07,-53.04,;49.57,-52.72,;50.6,-53.88,;50.06,-51.26,;49.03,-50.11,;49.51,-48.65,;51.02,-48.34,;52.06,-49.48,;51.57,-50.95,;51.5,-46.88,;50.6,-45.63,;51.5,-44.39,;52.97,-44.86,;54.3,-44.09,;54.29,-42.55,;55.63,-44.85,;55.64,-46.4,;54.3,-47.18,;52.96,-46.4,;56.97,-47.17,;56.97,-48.71,;58.3,-49.48,;59.64,-48.71,;59.63,-47.16,;60.96,-46.38,;58.29,-46.4,;45.54,-52.21,)|

COc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(nc23)-c2ccc3cn[nH]c3c2)c1 |r,wU:13.16,10.9,(64.68,-50.87,;65.71,-52.02,;67.22,-51.7,;67.7,-50.23,;69.21,-49.92,;70.23,-51.07,;69.75,-52.52,;70.77,-53.67,;72.28,-53.36,;73.3,-54.51,;72.76,-51.9,;71.74,-50.75,;72.22,-49.29,;73.73,-48.98,;74.76,-50.12,;74.27,-51.58,;74.2,-47.52,;73.3,-46.27,;74.21,-45.02,;75.67,-45.5,;77,-44.73,;76.99,-43.18,;78.34,-45.49,;78.34,-47.04,;77,-47.81,;75.67,-47.04,;79.67,-47.81,;79.67,-49.35,;81.01,-50.12,;82.35,-49.34,;83.82,-49.81,;84.72,-48.55,;83.8,-47.31,;82.33,-47.8,;81,-47.04,;68.25,-52.85,)|

COc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(nc23)-c2ccc3[nH]ncc3c2)c1 |r,wU:13.16,10.9,(1.93,-8.79,;2.96,-9.94,;4.46,-9.62,;4.95,-8.15,;6.46,-7.84,;7.48,-8.99,;6.99,-10.44,;8.02,-11.59,;9.53,-11.28,;10.55,-12.43,;10.01,-9.82,;8.99,-8.67,;9.47,-7.21,;10.97,-6.9,;12.01,-8.04,;11.52,-9.5,;11.45,-5.44,;10.55,-4.19,;11.45,-2.94,;12.92,-3.42,;14.25,-2.65,;14.24,-1.1,;15.58,-3.41,;15.59,-4.96,;14.25,-5.73,;12.92,-4.96,;16.92,-5.73,;18.25,-4.96,;19.58,-5.72,;19.59,-7.27,;20.73,-8.3,;20.11,-9.71,;18.57,-9.55,;18.25,-8.04,;16.92,-7.27,;5.49,-10.77,)|

COc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(nc23)-c2ccccc2)c1 |r,wU:13.16,10.9,(23.54,-9.14,;24.57,-10.28,;26.08,-9.97,;26.56,-8.49,;28.07,-8.18,;29.1,-9.33,;28.61,-10.79,;29.63,-11.94,;31.14,-11.63,;32.17,-12.78,;31.63,-10.16,;30.6,-9.01,;31.08,-7.55,;32.59,-7.24,;33.62,-8.38,;33.14,-9.85,;33.07,-5.78,;32.16,-4.53,;33.07,-3.29,;34.53,-3.77,;35.86,-2.99,;35.86,-1.45,;37.2,-3.75,;37.21,-5.3,;35.87,-6.08,;34.53,-5.31,;38.54,-6.07,;38.54,-7.61,;39.87,-8.38,;41.21,-7.61,;41.2,-6.06,;39.86,-5.3,;27.11,-11.11,)|

COc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(Nc4cccnc4)nc23)c1 |r,wU:13.16,10.9,(42.86,-10.01,;43.89,-11.16,;45.4,-10.84,;45.88,-9.37,;47.39,-9.06,;48.41,-10.21,;47.92,-11.67,;48.95,-12.82,;50.46,-12.5,;51.48,-13.66,;50.94,-11.04,;49.92,-9.89,;50.4,-8.43,;51.91,-8.12,;52.94,-9.26,;52.45,-10.73,;52.38,-6.66,;51.48,-5.41,;52.39,-4.17,;53.85,-4.64,;55.18,-3.87,;55.17,-2.33,;56.52,-4.63,;56.52,-6.18,;57.86,-6.95,;57.86,-8.49,;56.52,-9.26,;56.53,-10.8,;57.86,-11.57,;59.2,-10.79,;59.19,-9.25,;55.18,-6.96,;53.85,-6.18,;46.42,-11.99,)|

COc1cccc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(nc23)N2CCN(C)CC2)c1 |r,wU:13.16,10.9,(65.39,-9.9,;66.42,-11.05,;67.92,-10.73,;68.4,-9.25,;69.92,-8.94,;70.94,-10.09,;70.45,-11.55,;71.48,-12.7,;72.98,-12.39,;74.01,-13.54,;73.47,-10.92,;72.44,-9.77,;72.92,-8.31,;74.43,-8.01,;75.47,-9.14,;74.98,-10.61,;74.91,-6.54,;74.01,-5.29,;74.91,-4.05,;76.38,-4.53,;77.71,-3.75,;77.7,-2.21,;79.04,-4.52,;79.05,-6.07,;77.71,-6.84,;76.37,-6.07,;80.38,-6.84,;80.38,-8.39,;81.71,-9.15,;83.04,-8.39,;84.38,-9.16,;83.05,-6.84,;81.71,-6.07,;68.95,-11.87,)|

Nc1nc(Cl)nc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1nc2ccccc2s1 |r,wU:11.12,14.19,(17.43,-18.47,;17.43,-20.01,;18.77,-20.78,;18.77,-22.33,;20.11,-23.1,;17.44,-23.1,;16.1,-22.33,;14.64,-22.8,;13.73,-21.56,;14.64,-20.31,;16.1,-20.79,;14.16,-24.27,;12.65,-24.58,;12.17,-26.03,;13.19,-27.19,;14.71,-26.87,;15.19,-25.4,;12.71,-28.65,;13.74,-29.8,;11.2,-28.96,;10.18,-27.81,;8.64,-27.96,;8.02,-26.55,;6.57,-26.07,;6.25,-24.57,;7.4,-23.55,;8.86,-24.03,;9.16,-25.53,;10.5,-26.3,)|

Cc1csc(n1)NC(=O)C2CCC(CC2)n3cnc4c3nc(nc4N)Cl

Cc1cc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(Cl)nc23)nn1C |r,wU:10.13,7.6,(50.4,-25.24,;50.55,-26.78,;51.88,-27.55,;51.56,-29.06,;52.59,-30.21,;54.09,-29.9,;55.12,-31.05,;54.58,-28.44,;53.55,-27.29,;54.03,-25.83,;55.54,-25.52,;56.57,-26.66,;56.09,-28.13,;56.02,-24.06,;55.11,-22.81,;56.02,-21.57,;57.48,-22.05,;58.81,-21.27,;58.8,-19.73,;60.15,-22.04,;60.15,-23.59,;61.49,-24.35,;58.81,-24.36,;57.48,-23.59,;50.02,-29.21,;49.4,-27.8,;47.9,-27.47,)|

Cc1nnc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(Cl)nc23)s1 |r,wU:11.14,8.7,(65.22,-29.75,;66.73,-30.08,;67.88,-29.06,;69.21,-29.83,;68.89,-31.35,;69.91,-32.5,;71.42,-32.18,;72.44,-33.33,;71.9,-30.72,;70.88,-29.57,;71.36,-28.11,;72.86,-27.8,;73.9,-28.94,;73.41,-30.41,;73.34,-26.34,;72.44,-25.09,;73.35,-23.85,;74.81,-24.33,;76.14,-23.55,;76.13,-22.01,;77.47,-24.32,;77.48,-25.87,;78.81,-26.63,;76.14,-26.64,;74.81,-25.87,;67.35,-31.49,)|

Nc1nc(Cl)nc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1ccc2ncsc2c1 |r,wU:11.12,14.19,(14.91,-35.45,;14.92,-37,;16.25,-37.76,;16.26,-39.31,;17.6,-40.08,;14.92,-40.08,;13.59,-39.31,;12.12,-39.79,;11.22,-38.54,;12.12,-37.29,;13.59,-37.77,;11.64,-41.25,;10.14,-41.56,;9.66,-43.02,;10.68,-44.17,;12.19,-43.85,;12.68,-42.39,;10.2,-45.63,;11.22,-46.78,;8.69,-45.95,;7.66,-44.79,;8.15,-43.34,;7.13,-42.19,;5.62,-42.5,;4.36,-41.58,;3.1,-42.49,;3.58,-43.97,;5.13,-43.97,;6.16,-45.12,)|

Nc1nc(Cl)nc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1ccccn1 |r,wU:11.12,14.19,(32.59,-36.33,;32.6,-37.87,;33.94,-38.64,;33.94,-40.19,;35.28,-40.96,;32.6,-40.96,;31.27,-40.19,;29.8,-40.66,;28.9,-39.42,;29.81,-38.17,;31.27,-38.65,;29.32,-42.13,;27.82,-42.44,;27.34,-43.89,;28.36,-45.05,;29.87,-44.73,;30.36,-43.26,;27.88,-46.51,;28.9,-47.66,;26.37,-46.82,;25.34,-45.67,;25.83,-44.21,;24.81,-43.06,;23.3,-43.38,;22.82,-44.85,;23.84,-45.99,)|

Nc1nc(Cl)nc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1ncc[nH]1 |r,wU:11.12,14.19,(51.87,-36.76,;51.88,-38.3,;53.21,-39.06,;53.22,-40.61,;54.55,-41.38,;51.88,-41.39,;50.55,-40.61,;49.08,-41.09,;48.18,-39.84,;49.09,-38.6,;50.55,-39.08,;48.6,-42.55,;47.1,-42.86,;46.62,-44.32,;47.64,-45.47,;49.15,-45.15,;49.64,-43.69,;47.16,-46.93,;48.18,-48.08,;45.65,-47.24,;44.63,-46.09,;44.95,-44.58,;43.62,-43.8,;42.47,-44.83,;43.09,-46.24,)|

Cc1cnc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(Cl)nc23)s1 |r,wU:11.14,8.7,(4.59,-8.31,;4.75,-9.84,;3.6,-10.86,;4.22,-12.27,;5.76,-12.12,;6.78,-13.27,;8.29,-12.96,;9.31,-14.11,;8.77,-11.5,;7.75,-10.35,;8.23,-8.89,;9.74,-8.58,;10.77,-9.72,;10.28,-11.19,;10.21,-7.12,;9.31,-5.87,;10.22,-4.63,;11.68,-5.11,;13.01,-4.33,;13,-2.79,;14.34,-5.1,;14.35,-6.65,;15.68,-7.41,;13.01,-7.42,;11.68,-6.65,;6.08,-10.61,)|

NC(=O)Cc1csc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(Cl)nc23)n1 |r,wU:14.17,11.10,(21.85,-8.74,;20.81,-9.88,;19.31,-9.55,;21.28,-11.35,;22.78,-11.68,;23.93,-10.66,;25.26,-11.43,;24.94,-12.94,;25.96,-14.09,;27.47,-13.78,;28.5,-14.93,;27.95,-12.32,;26.93,-11.17,;27.41,-9.71,;28.92,-9.4,;29.95,-10.54,;29.46,-12,;29.39,-7.94,;28.49,-6.69,;29.4,-5.45,;30.86,-5.92,;32.19,-5.15,;32.18,-3.61,;33.52,-5.91,;33.53,-7.46,;34.86,-8.23,;32.19,-8.23,;30.86,-7.46,;23.4,-13.09,)|

NC(=O)Cc1cnc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(Cl)nc23)s1 |r,wU:14.17,11.10,(42.59,-9.68,;43.83,-8.78,;43.68,-7.25,;45.24,-9.41,;45.39,-10.95,;44.25,-11.96,;44.87,-13.37,;46.41,-13.23,;47.43,-14.38,;48.94,-14.07,;49.96,-15.22,;49.42,-12.6,;48.4,-11.45,;48.88,-10,;50.38,-9.69,;51.42,-10.82,;50.93,-12.29,;50.86,-8.22,;49.96,-6.98,;50.87,-5.73,;52.33,-6.21,;53.66,-5.44,;53.65,-3.9,;54.99,-6.2,;55,-7.75,;56.33,-8.52,;53.66,-8.52,;52.33,-7.75,;46.73,-11.72,)|

Nc1nc(Cl)nc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1nc(cs1)C(F)(F)F |r,wU:11.12,14.19,(74.12,-4.48,;74.13,-6.02,;75.47,-6.78,;75.47,-8.33,;76.81,-9.1,;74.13,-9.11,;72.8,-8.33,;71.34,-8.81,;70.43,-7.56,;71.34,-6.32,;72.8,-6.8,;70.86,-10.27,;69.35,-10.58,;68.87,-12.04,;69.9,-13.19,;71.41,-12.87,;71.89,-11.41,;69.41,-14.65,;70.44,-15.8,;67.9,-14.96,;66.88,-13.81,;65.34,-13.96,;64.72,-12.55,;65.87,-11.53,;67.2,-12.3,;63.22,-12.22,;62.75,-10.75,;62.18,-13.36,;61.72,-11.81,)|

Nc1nc(Cl)nc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1nc(cs1)-c1ccccc1 |r,wU:11.12,14.19,(14.53,-21,;14.54,-22.54,;15.87,-23.31,;15.88,-24.86,;17.21,-25.63,;14.54,-25.63,;13.2,-24.86,;11.74,-25.33,;10.84,-24.09,;11.74,-22.84,;13.21,-23.32,;11.26,-26.8,;9.75,-27.11,;9.27,-28.56,;10.3,-29.72,;11.81,-29.4,;12.3,-27.93,;9.81,-31.18,;10.84,-32.33,;8.31,-31.49,;7.28,-30.34,;5.74,-30.49,;5.12,-29.08,;6.27,-28.06,;7.6,-28.83,;3.62,-28.75,;3.15,-27.28,;1.65,-26.95,;.61,-28.09,;1.08,-29.57,;2.58,-29.89,)|

COc1ccc2nc(NC(=O)[C@H]3CC[C@H](CC3)n3cnc4c(N)nc(Cl)nc34)sc2c1 |r,wU:14.17,11.10,(24.57,-24.01,;23.42,-25.03,;23.74,-26.54,;22.59,-27.57,;22.91,-29.07,;24.36,-29.54,;24.98,-30.95,;26.52,-30.81,;27.54,-31.96,;29.05,-31.65,;30.08,-32.8,;29.53,-30.18,;28.51,-29.03,;28.99,-27.57,;30.5,-27.27,;31.53,-28.4,;31.04,-29.87,;30.97,-25.8,;30.07,-24.55,;30.98,-23.31,;32.44,-23.79,;33.77,-23.01,;33.77,-21.47,;35.11,-23.77,;35.11,-25.33,;36.45,-26.09,;33.78,-26.1,;32.44,-25.33,;26.84,-29.3,;25.5,-28.53,;25.19,-27.03,)|

COc1cccc2sc(NC(=O)[C@H]3CC[C@H](CC3)n3cnc4c(N)nc(Cl)nc34)nc12 |r,wU:15.18,12.11,(43.36,-30.19,;44.82,-30.67,;45.97,-29.64,;45.66,-28.15,;46.8,-27.12,;48.26,-27.6,;48.57,-29.1,;49.9,-29.87,;49.58,-31.39,;50.61,-32.54,;52.12,-32.22,;53.14,-33.37,;52.6,-30.76,;51.58,-29.61,;52.05,-28.15,;53.56,-27.84,;54.6,-28.98,;54.11,-30.45,;54.04,-26.38,;53.14,-25.13,;54.04,-23.88,;55.51,-24.36,;56.84,-23.59,;56.83,-22.04,;58.17,-24.35,;58.18,-25.9,;59.52,-26.67,;56.84,-26.67,;55.51,-25.9,;48.04,-31.53,;47.42,-30.12,)|

Nc1nc(Cl)nc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1nc2ccc(O)cc2s1 |r,wU:11.12,14.19,(76.62,-21.9,;76.63,-23.44,;77.96,-24.2,;77.97,-25.75,;79.3,-26.52,;76.63,-26.53,;75.29,-25.76,;73.83,-26.23,;72.92,-24.98,;73.83,-23.74,;75.3,-24.22,;73.35,-27.69,;71.84,-28,;71.36,-29.46,;72.39,-30.61,;73.9,-30.3,;74.38,-28.83,;71.9,-32.08,;72.93,-33.23,;70.39,-32.39,;69.37,-31.24,;67.83,-31.38,;67.21,-29.97,;65.76,-29.49,;65.44,-28,;66.59,-26.97,;66.28,-25.46,;68.05,-27.45,;68.36,-28.95,;69.69,-29.72,)|

Nc1nc(Cl)nc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1nc2c(O)cccc2s1 |r,wU:11.12,14.19,(14.05,-42.03,;14.05,-43.58,;15.39,-44.34,;15.4,-45.89,;16.73,-46.66,;14.06,-46.66,;12.72,-45.89,;11.26,-46.37,;10.35,-45.12,;11.26,-43.87,;12.72,-44.35,;10.78,-47.83,;9.27,-48.14,;8.79,-49.6,;9.82,-50.75,;11.33,-50.44,;11.81,-48.97,;9.33,-52.21,;10.36,-53.36,;7.82,-52.53,;6.8,-51.38,;5.26,-51.52,;4.64,-50.11,;3.19,-49.63,;2.04,-50.66,;2.87,-48.14,;4.02,-47.11,;5.48,-47.59,;5.79,-49.09,;7.12,-49.86,)|

NC(=O)Cc1ccc2nc(NC(=O)[C@H]3CC[C@H](CC3)n3cnc4c(N)nc(Cl)nc34)sc2c1 |r,wU:16.19,13.12,(25.2,-43.33,;25.51,-44.84,;26.98,-45.33,;24.36,-45.87,;24.68,-47.38,;23.53,-48.41,;23.85,-49.9,;25.3,-50.38,;25.92,-51.79,;27.46,-51.64,;28.48,-52.79,;29.99,-52.48,;31.01,-53.63,;30.47,-51.02,;29.45,-49.87,;29.93,-48.41,;31.44,-48.1,;32.47,-49.24,;31.98,-50.7,;31.91,-46.64,;31.01,-45.39,;31.92,-44.14,;33.38,-44.62,;34.71,-43.85,;34.7,-42.3,;36.05,-44.61,;36.05,-46.16,;37.39,-46.93,;34.72,-46.93,;33.38,-46.16,;27.78,-50.13,;26.44,-49.36,;26.13,-47.86,)|

NC(=O)c1ccc2nc(NC(=O)[C@H]3CC[C@H](CC3)n3cnc4c(N)nc(Cl)nc34)sc2c1 |r,wU:15.18,12.11,(43.29,-45.93,;44.75,-46.41,;45.9,-45.38,;45.07,-47.92,;43.92,-48.94,;44.23,-50.44,;45.68,-50.92,;46.3,-52.33,;47.84,-52.18,;48.87,-53.33,;50.38,-53.02,;51.4,-54.17,;50.86,-51.56,;49.84,-50.4,;50.32,-48.95,;51.82,-48.64,;52.86,-49.77,;52.37,-51.24,;52.3,-47.17,;51.4,-45.93,;52.31,-44.68,;53.77,-45.16,;55.1,-44.38,;55.09,-42.84,;56.44,-45.15,;56.44,-46.7,;57.78,-47.47,;55.1,-47.47,;53.77,-46.7,;48.16,-50.67,;46.83,-49.9,;46.52,-48.4,)|

Nc1nc(Cl)nc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1nc2ccc(F)cc2s1 |r,wU:11.12,14.19,(75.4,-43.26,;75.4,-44.81,;76.74,-45.57,;76.75,-47.12,;78.08,-47.89,;75.41,-47.89,;74.07,-47.12,;72.61,-47.6,;71.7,-46.35,;72.61,-45.1,;74.07,-45.58,;72.13,-49.06,;70.62,-49.37,;70.14,-50.83,;71.16,-51.98,;72.68,-51.67,;73.16,-50.2,;70.68,-53.44,;71.71,-54.59,;69.17,-53.76,;68.15,-52.61,;66.61,-52.75,;65.99,-51.34,;64.54,-50.86,;64.22,-49.37,;65.37,-48.34,;65.06,-46.83,;66.83,-48.82,;67.13,-50.32,;68.47,-51.09,)|

Nc1nc(Cl)nc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1nc2c(F)cc(F)cc2s1 |r,wU:11.12,14.19,(14.86,-2.51,;14.86,-4.06,;16.2,-4.82,;16.21,-6.37,;17.54,-7.14,;14.87,-7.14,;13.53,-6.37,;12.07,-6.85,;11.16,-5.6,;12.07,-4.35,;13.53,-4.83,;11.59,-8.31,;10.08,-8.62,;9.6,-10.08,;10.63,-11.23,;12.14,-10.91,;12.62,-9.45,;10.14,-12.69,;11.17,-13.84,;8.63,-13.01,;7.61,-11.85,;6.07,-12,;5.45,-10.59,;4,-10.11,;2.85,-11.14,;3.68,-8.62,;4.83,-7.59,;4.52,-6.08,;6.29,-8.07,;6.6,-9.57,;7.93,-10.34,)|

CN1CCc2nc(NC(=O)[C@H]3CC[C@H](CC3)n3cnc4c(N)nc(Cl)nc34)sc2C1 |r,wU:13.16,10.9,(24.36,-7.31,;24.67,-8.82,;23.53,-9.84,;23.84,-11.35,;25.3,-11.82,;25.92,-13.22,;27.46,-13.08,;28.48,-14.23,;29.99,-13.91,;31.02,-15.06,;30.47,-12.45,;29.45,-11.3,;29.93,-9.84,;31.44,-9.53,;32.47,-10.67,;31.98,-12.14,;31.92,-8.07,;31.01,-6.82,;31.92,-5.58,;33.38,-6.05,;34.71,-5.28,;34.71,-3.74,;36.05,-6.04,;36.05,-7.59,;37.39,-8.36,;34.72,-8.36,;33.38,-7.59,;27.78,-11.56,;26.44,-10.79,;26.13,-9.3,)|

CC(C)N1CCc2nc(NC(=O)[C@H]3CC[C@H](CC3)n3cnc4c(N)nc(Cl)nc34)sc2C1 |r,wU:15.18,12.11,(45.88,-7.03,;44.73,-8.05,;43.27,-7.57,;45.05,-9.56,;43.9,-10.59,;44.22,-12.09,;45.68,-12.56,;46.29,-13.97,;47.83,-13.82,;48.86,-14.97,;50.37,-14.66,;51.39,-15.81,;50.85,-13.2,;49.83,-12.04,;50.31,-10.59,;51.81,-10.28,;52.85,-11.41,;52.36,-12.88,;52.29,-8.81,;51.39,-7.57,;52.29,-6.32,;53.76,-6.8,;55.09,-6.02,;55.08,-4.48,;56.42,-6.79,;56.43,-8.34,;57.76,-9.11,;55.09,-9.11,;53.76,-8.34,;48.15,-12.31,;46.82,-11.54,;46.5,-10.04,)|

Nc1nc(Cl)nc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1nc2CCN(Cc2s1)C1CC1

Nc1nc(Cl)nc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1nc2CCNCc2s1 |r,wU:11.12,14.19,(14.03,-18.46,;14.04,-20,;15.37,-20.77,;15.38,-22.32,;16.72,-23.09,;14.04,-23.09,;12.71,-22.32,;11.24,-22.79,;10.34,-21.55,;11.24,-20.3,;12.71,-20.78,;10.76,-24.26,;9.26,-24.57,;8.78,-26.03,;9.8,-27.18,;11.31,-26.86,;11.8,-25.4,;9.32,-28.64,;10.34,-29.79,;7.81,-28.95,;6.78,-27.8,;5.24,-27.95,;4.63,-26.54,;3.17,-26.08,;2.85,-24.57,;4,-23.54,;5.46,-24.02,;5.77,-25.52,;7.1,-26.29,)|

CC1(C)Cc2nc(NC(=O)[C@H]3CC[C@H](CC3)n3cnc4c(N)nc(Cl)nc34)sc2C(C)(C)N1 |r,wU:13.16,10.9,(21.59,-25.94,;22.93,-25.18,;21.6,-24.4,;23.25,-26.69,;24.71,-27.16,;25.32,-28.56,;26.86,-28.42,;27.89,-29.57,;29.4,-29.25,;30.42,-30.4,;29.88,-27.79,;28.86,-26.64,;29.34,-25.18,;30.84,-24.87,;31.88,-26.01,;31.39,-27.48,;31.32,-23.41,;30.42,-22.16,;31.32,-20.92,;32.79,-21.4,;34.12,-20.62,;34.11,-19.08,;35.45,-21.39,;35.46,-22.94,;36.79,-23.7,;34.12,-23.71,;32.78,-22.94,;27.19,-26.9,;25.85,-26.13,;25.53,-24.64,;25.93,-23.14,;27.02,-24.23,;24.08,-24.16,)|

Nc1nc(Cl)nc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1nc2CCOCc2s1 |r,wU:11.12,14.19,(53.68,-20.14,;53.69,-21.69,;55.03,-22.45,;55.03,-24,;56.37,-24.77,;53.69,-24.77,;52.36,-24,;50.89,-24.48,;49.99,-23.23,;50.9,-21.98,;52.36,-22.46,;50.41,-25.94,;48.91,-26.25,;48.43,-27.71,;49.45,-28.86,;50.96,-28.54,;51.45,-27.08,;48.97,-30.32,;49.99,-31.47,;47.46,-30.64,;46.43,-29.48,;44.89,-29.63,;44.28,-28.23,;42.82,-27.76,;42.51,-26.25,;43.65,-25.22,;45.11,-25.71,;45.42,-27.2,;46.76,-27.97,)|

Nc1nc(Cl)nc2n(cnc12)[C@@H]1CC[C@@H](CC1)C(=O)Nc1nc2CCS(=O)(=O)Cc2s1 |r,wU:11.12,14.19,(78.25,-20.67,;78.26,-22.21,;79.6,-22.97,;79.6,-24.52,;80.94,-25.29,;78.26,-25.3,;76.93,-24.52,;75.46,-25,;74.56,-23.75,;75.47,-22.51,;76.93,-22.98,;74.98,-26.46,;73.48,-26.77,;73,-28.23,;74.02,-29.38,;75.53,-29.07,;76.02,-27.6,;73.54,-30.85,;74.56,-32,;72.03,-31.16,;71,-30.01,;69.46,-30.15,;68.85,-28.75,;67.39,-28.28,;67.08,-26.77,;68.21,-25.74,;67.12,-24.65,;68.62,-24.24,;69.68,-26.23,;69.99,-27.72,;71.33,-28.49,)|

Cc1csc(NC(=O)[C@H]2CC[C@H](CC2)n2cnc3c(N)nc(F)nc23)n1 |r,wU:11.14,8.7,(4.23,-45.63,;5.68,-46.1,;6.83,-45.08,;8.16,-45.85,;7.84,-47.36,;8.87,-48.51,;10.37,-48.2,;11.4,-49.35,;10.86,-46.74,;9.83,-45.58,;10.31,-44.13,;11.82,-43.82,;12.86,-44.95,;12.37,-46.42,;12.3,-42.35,;11.4,-41.11,;12.3,-39.86,;13.77,-40.34,;15.1,-39.56,;15.09,-38.02,;16.43,-40.33,;16.44,-41.88,;17.77,-42.65,;15.1,-42.65,;13.76,-41.88,;6.3,-47.51,)|

CN1CCc2nc(NC(=O)[C@H]3CC[C@H](CC3)n3cnc4c(N)nc(F)nc34)sc2C1 |r,wU:13.16,10.9,(23.79,-42.21,;24.11,-43.72,;22.96,-44.75,;23.28,-46.25,;24.73,-46.72,;25.35,-48.13,;26.89,-47.98,;27.91,-49.13,;29.42,-48.82,;30.45,-49.97,;29.91,-47.36,;28.88,-46.2,;29.36,-44.75,;30.87,-44.44,;31.9,-45.57,;31.42,-47.04,;31.35,-42.97,;30.45,-41.73,;31.35,-40.48,;32.82,-40.96,;34.15,-40.18,;34.14,-38.64,;35.48,-40.95,;35.49,-42.5,;36.82,-43.27,;34.15,-43.27,;32.81,-42.5,;27.21,-46.47,;25.88,-45.7,;25.56,-44.2,)|

CC1(C)Cc2nc(NC(=O)[C@H]3CC[C@H](CC3)n3cnc4c(N)nc(F)nc34)sc2C(C)(C)N1 |r,wU:13.16,10.9,(42.91,-44.68,;44.24,-43.92,;42.91,-43.14,;44.56,-45.43,;46.02,-45.89,;46.64,-47.3,;48.17,-47.15,;49.2,-48.3,;50.71,-47.99,;51.73,-49.14,;51.19,-46.53,;50.17,-45.38,;50.65,-43.92,;52.15,-43.61,;53.19,-44.75,;52.7,-46.21,;52.63,-42.15,;51.73,-40.9,;52.64,-39.66,;54.1,-40.13,;55.43,-39.36,;55.42,-37.82,;56.76,-40.12,;56.77,-41.67,;58.1,-42.44,;55.43,-42.44,;54.1,-41.67,;48.5,-45.64,;47.16,-44.87,;46.84,-43.37,;47.24,-41.88,;48.33,-42.97,;45.39,-42.89,)|

C(c1ccc(Cn2ccc(cc2)=[N+]2CCCCC2)cc1)n1ccc(cc1)=[N+]1CCCCC1 |(4.21,-2.95,;2.68,-2.95,;1.91,-4.28,;.37,-4.28,;-.39,-2.95,;-1.93,-2.95,;-2.71,-1.62,;-2.68,-.1,;-4.01,.72,;-5.34,-.03,;-5.38,-1.57,;-4.05,-2.36,;-6.67,.76,;-6.64,2.3,;-7.95,3.1,;-9.3,2.37,;-9.33,.83,;-8.02,.02,;.37,-1.62,;1.91,-1.62,;4.98,-1.62,;3.65,-.87,;3.64,.67,;4.98,1.45,;6.31,.69,;6.31,-.85,;4.97,2.98,;6.31,3.75,;6.3,5.27,;4.98,6.06,;3.65,5.27,;3.65,3.73,)|

C(c1ccc(cc1)-c1ccc(Cn2ccc(cc2)=[N+]2CCCCC2)cc1)n1ccc(cc1)=[N+]1CCCCC1 |(-4.88,-2.66,;-3.33,-2.66,;-2.58,-1.33,;-1.03,-1.33,;-.26,-2.66,;-1.03,-3.99,;-2.58,-3.99,;1.28,-2.66,;2.05,-1.33,;3.58,-1.32,;4.37,-2.66,;5.91,-2.66,;6.68,-1.33,;8.21,-1.33,;8.99,,;8.21,1.34,;6.65,1.34,;5.91,,;8.98,2.68,;10.51,2.68,;11.28,4.01,;10.51,5.34,;8.98,5.34,;8.21,4.01,;3.58,-3.99,;2.05,-3.99,;-5.66,-1.33,;-7.02,-2.05,;-8.34,-1.23,;-8.29,.29,;-6.93,1.02,;-5.61,.21,;-9.59,1.1,;-9.55,2.65,;-10.86,3.47,;-12.19,2.75,;-12.26,1.2,;-10.95,.38,)|

C(C1CC1Cn1ccc(cc1)=[N+]1CCCC1)n1ccc(cc1)=[N+]1CCCC1 |(-2.12,-3.79,;-.75,-4.56,;.03,-5.89,;.78,-4.56,;2.13,-3.76,;2.11,-2.22,;3.44,-1.48,;3.44,.06,;2.11,.83,;.78,.06,;.78,-1.48,;2.11,2.37,;3.36,3.28,;2.85,4.73,;1.31,4.73,;.85,3.26,;-2.12,-2.25,;-3.42,-1.48,;-3.42,.06,;-2.12,.83,;-.76,.06,;-.75,-1.48,;-2.12,2.37,;-3.35,3.28,;-2.89,4.75,;-1.35,4.75,;-.86,3.28,)|

C[N+](c1ccc(Cl)cc1)=c1ccn(Cc2ccc(Cn3ccc(cc3)=[N+](C)c3ccc(Cl)cc3)cc2)cc1 |(-7.59,-.82,;-6.24,-.09,;-6.2,1.47,;-4.83,2.19,;-4.82,3.74,;-6.14,4.53,;-6.1,6.07,;-7.48,3.78,;-7.52,2.24,;-4.9,-.89,;-3.57,-.14,;-2.24,-.94,;-2.27,-2.46,;-1.5,-3.81,;.05,-3.81,;.82,-2.46,;2.36,-2.46,;3.14,-3.8,;4.68,-3.8,;5.43,-2.46,;6.77,-1.71,;6.77,-.16,;5.42,.6,;4.09,-.17,;4.09,-1.71,;5.42,2.14,;6.77,2.92,;4.09,2.89,;2.81,2.14,;1.47,2.89,;1.46,4.42,;.12,5.18,;2.78,5.18,;4.1,4.42,;2.36,-5.12,;.82,-5.12,;-3.62,-3.21,;-4.95,-2.42,)|

C(c1cccc(Cn2ccc(cc2)=[N+]2CCCC2)c1)n1ccc(cc1)=[N+]1CCCC1 |(-2.65,-3.2,;-1.32,-3.97,;-1.32,-5.51,;.01,-6.28,;1.34,-5.51,;1.34,-3.97,;2.68,-3.2,;2.67,-1.66,;4,-.89,;4,.65,;2.64,1.42,;1.33,.65,;1.33,-.91,;2.64,2.96,;3.88,3.87,;3.41,5.31,;1.87,5.31,;1.38,3.85,;.01,-3.2,;-2.65,-1.66,;-1.31,-.89,;-1.32,.65,;-2.66,1.42,;-4.01,.65,;-4.01,-.89,;-2.66,2.96,;-3.91,3.87,;-3.45,5.32,;-1.91,5.34,;-1.42,3.87,)|

C(c1cccc(c1)-c1cccc(Cn2ccc(cc2)=[N+]2CCCC2)c1)n1ccc(cc1)=[N+]1CCCC1 |(-4.02,.24,;-3.24,-1.11,;-4,-2.43,;-3.24,-3.77,;-1.7,-3.77,;-.93,-2.43,;-1.7,-1.11,;.62,-2.43,;1.38,-3.77,;2.93,-3.77,;3.71,-2.43,;2.93,-1.09,;3.69,.26,;5.22,.26,;6,-1.08,;7.54,-1.08,;8.31,.29,;7.53,1.61,;5.98,1.59,;9.86,.29,;10.75,-.97,;12.22,-.47,;12.2,1.07,;10.75,1.54,;1.38,-1.11,;-5.55,.21,;-6.92,-.5,;-8.22,.32,;-8.17,1.86,;-6.82,2.57,;-5.5,1.76,;-9.5,2.69,;-9.58,4.22,;-11.07,4.59,;-11.88,3.28,;-10.91,2.11,)|

C(c1cccc(Cn2ccc(cc2)=[N+]2CCCCC2)c1)n1ccc(cc1)=[N+]1CCCCC1 |(-2.65,-3.58,;-1.33,-4.34,;-1.33,-5.89,;,-6.65,;1.34,-5.89,;1.34,-4.32,;2.68,-3.55,;2.66,-2.01,;3.97,-1.24,;3.97,.3,;2.66,1.05,;1.31,.27,;1.34,-1.27,;2.64,2.58,;3.97,3.35,;3.97,4.89,;2.66,5.64,;1.34,4.89,;1.34,3.33,;,-3.55,;-2.65,-2.01,;-1.31,-1.24,;-1.33,.3,;-2.65,1.07,;-3.99,.3,;-3.99,-1.24,;-2.66,2.61,;-1.33,3.36,;-1.35,4.89,;-2.66,5.65,;-4.01,4.89,;-4.01,3.35,)|

C[N+](c1ccc(Cl)cc1)=c1ccn(Cc2cccc(Cn3ccc(cc3)=[N+](C)c3ccc(Cl)cc3)c2)cc1 |(1.31,2.77,;2.64,2,;3.97,2.78,;3.97,4.31,;5.3,5.08,;6.63,4.32,;7.98,5.09,;6.65,2.78,;5.33,2,;2.66,.47,;3.97,-.29,;3.97,-1.83,;2.66,-2.6,;2.68,-4.14,;1.34,-4.91,;1.34,-6.45,;,-7.23,;-1.32,-6.45,;-1.32,-4.92,;-2.65,-4.14,;-2.65,-2.6,;-3.99,-1.83,;-3.99,-.29,;-2.65,.49,;-1.32,-.29,;-1.31,-1.83,;-2.66,2.02,;-1.35,2.8,;-4.01,2.77,;-4.01,4.31,;-5.34,5.06,;-6.65,4.27,;-8,5.06,;-6.63,2.75,;-5.31,2,;,-4.14,;1.34,-1.85,;1.33,-.29,)|

Clc1cc(Cl)cc(c1)-c1cc[n+](Cc2cccc(c2)-c2cccc(C[n+]3ccc(cc3)-c3cc(Cl)cc(Cl)c3)c2)cc1

C[N+](c1ccccc1)=c1ccn(CC2CC2Cn2ccc(cc2)=[N+](C)c2ccccc2)cc1 |(-.79,2.58,;-2.1,1.81,;-3.45,2.58,;-3.45,4.12,;-4.78,4.89,;-6.11,4.12,;-6.09,2.56,;-4.78,1.81,;-2.09,.27,;-3.42,-.5,;-3.42,-2.04,;-2.09,-2.81,;-2.09,-4.35,;-.75,-5.12,;.03,-6.45,;.78,-5.11,;2.13,-4.32,;2.12,-2.78,;3.44,-2.04,;3.44,-.5,;2.12,.27,;.78,-.5,;.78,-2.04,;2.11,1.81,;.77,2.58,;3.44,2.58,;4.77,1.81,;6.11,2.58,;6.1,4.12,;4.74,4.89,;3.43,4.12,;-.75,-2.04,;-.76,-.5,)|

C(c1ccc(Cn2ccc(cc2)=[N+]2CCCC2)cc1)n1ccc(cc1)=[N+]1CCCC1 |(4.09,-2.71,;2.55,-2.71,;1.78,-4.04,;.24,-4.04,;-.53,-2.71,;-2.05,-2.71,;-2.84,-1.38,;-2.79,.16,;-4.12,.96,;-5.48,.21,;-5.5,-1.33,;-4.19,-2.12,;-6.79,1,;-6.91,2.54,;-8.4,2.89,;-9.21,1.56,;-8.21,.41,;.24,-1.38,;1.78,-1.38,;4.86,-1.38,;3.51,-.63,;3.51,.91,;4.86,1.7,;6.19,.93,;6.19,-.61,;4.86,3.22,;6.08,4.13,;5.6,5.58,;4.07,5.58,;3.6,4.12,)|

C[N+](c1ccc(Cl)cc1)=c1ccn(Cc2cccc(c2)-c2cccc(Cn3ccc(cc3)=[N+](C)c3ccc(Cl)cc3)c2)cc1 |(-11.11,.84,;-9.76,1.56,;-9.69,3.08,;-8.32,3.8,;-8.27,5.35,;-9.57,6.15,;-9.52,7.69,;-10.93,5.43,;-10.99,3.9,;-8.44,.72,;-7.09,1.44,;-5.77,.62,;-5.83,-.92,;-4.29,-.9,;-3.51,-2.23,;-4.27,-3.55,;-3.51,-4.9,;-1.97,-4.9,;-1.2,-3.55,;-1.97,-2.23,;.35,-3.55,;1.11,-4.9,;2.64,-4.9,;3.43,-3.55,;2.64,-2.23,;3.39,-.88,;4.93,-.88,;5.68,.46,;7.22,.47,;8.02,-.85,;7.25,-2.2,;5.7,-2.2,;9.56,-.85,;10.33,-2.18,;10.3,.47,;11.83,.47,;12.58,1.8,;11.82,3.13,;12.58,4.46,;10.29,3.09,;9.54,1.76,;1.09,-2.23,;-7.19,-1.62,;-8.51,-.8,)|

C(c1cccc(c1)-c1cccc(Cn2ccc(cc2)=[N+]2CCCCC2)c1)n1ccc(cc1)=[N+]1CCCCC1 |(-4.03,.12,;-3.24,-1.22,;-4.01,-2.54,;-3.24,-3.86,;-1.7,-3.86,;-.93,-2.52,;-1.7,-1.2,;.61,-2.52,;1.36,-3.86,;2.88,-3.86,;3.66,-2.52,;2.88,-1.19,;3.66,.14,;5.19,.14,;5.96,-1.19,;7.5,-1.18,;8.24,.17,;7.48,1.49,;5.93,1.47,;9.78,.17,;10.56,-1.17,;12.08,-1.15,;12.84,.18,;12.07,1.49,;10.53,1.49,;1.36,-1.2,;-5.56,.12,;-6.91,-.61,;-8.23,.23,;-8.18,1.75,;-6.8,2.47,;-5.49,1.63,;-9.47,2.56,;-9.4,4.11,;-10.69,4.92,;-12.06,4.21,;-12.11,2.69,;-10.8,1.83,)|

C[N+](c1ccccc1)=c1ccn(Cc2ccc(Cn3ccc(cc3)=[N+](C)c3ccccc3)cc2)cc1 |(-7.75,-.52,;-6.38,.2,;-6.35,1.74,;-7.66,2.55,;-7.66,4.08,;-6.29,4.83,;-4.97,4.03,;-4.99,2.49,;-5.06,-.59,;-3.72,.16,;-2.38,-.64,;-2.42,-2.18,;-1.65,-3.51,;-.11,-3.51,;.66,-2.18,;2.2,-2.16,;2.98,-3.49,;4.52,-3.49,;5.28,-2.16,;3.93,-1.41,;3.93,.13,;5.27,.9,;6.61,.13,;6.61,-1.41,;5.27,2.45,;6.6,3.22,;3.93,3.19,;2.64,2.43,;1.32,3.18,;1.31,4.71,;2.62,5.48,;3.95,4.71,;2.2,-4.82,;.66,-4.82,;-3.78,-2.93,;-5.09,-2.11,)|

C[N+](c1ccc(Cl)cc1)=c1ccn(CC2CC2Cn2ccc(cc2)=[N+](C)c2ccc(Cl)cc2)cc1 |(-.77,2.3,;-2.1,1.53,;-3.45,2.3,;-4.76,1.53,;-6.11,2.28,;-6.11,3.82,;-7.44,4.59,;-4.78,4.61,;-3.45,3.84,;-2.09,-.01,;-3.42,-.78,;-3.42,-2.32,;-2.09,-3.09,;-2.09,-4.63,;-.75,-5.4,;.03,-6.73,;.78,-5.4,;2.12,-4.6,;2.12,-3.06,;3.45,-2.31,;3.45,-.78,;2.11,-.01,;.78,-.78,;.78,-2.32,;2.11,1.53,;.77,2.3,;3.43,2.3,;4.77,1.53,;6.1,2.3,;6.1,3.84,;7.43,4.61,;4.74,4.61,;3.43,3.82,;-.76,-2.32,;-.76,-.78,)|

C(c1ccc(cc1)-c1ccc(Cn2ccc(cc2)=[N+]2CCCC2)cc1)n1ccc(cc1)=[N+]1CCCC1 |(-4.9,-2.46,;-3.36,-2.46,;-2.61,-1.12,;-1.07,-1.12,;-.3,-2.46,;-1.07,-3.79,;-2.61,-3.79,;1.24,-2.46,;2.01,-1.12,;3.55,-1.12,;4.32,-2.46,;5.86,-2.46,;6.63,-1.12,;8.17,-1.12,;8.92,.2,;8.17,1.53,;6.6,1.53,;5.86,.2,;8.92,2.89,;10.45,3.03,;10.76,4.54,;9.43,5.31,;8.28,4.27,;3.55,-3.79,;2.01,-3.79,;-5.69,-1.12,;-7.04,-1.85,;-8.35,-1.03,;-8.32,.49,;-6.95,1.21,;-5.64,.4,;-9.63,1.31,;-9.72,2.82,;-11.21,3.19,;-12.02,1.88,;-11.05,.72,)|

Clc1cc(Cl)cc(c1)-c1cc[n+](Cc2ccc(cc2)-c2ccc(C[n+]3ccc(cc3)-c3cc(Cl)cc(Cl)c3)cc2)cc1

C[N+](c1ccccc1)=c1ccn(Cc2cccc(Cn3ccc(cc3)=[N+](C)c3ccccc3)c2)cc1 |(1.31,3.04,;2.65,2.28,;3.98,3.06,;3.97,4.6,;5.31,5.35,;6.65,4.6,;6.66,3.06,;5.34,2.28,;2.67,.74,;3.98,-.02,;3.98,-1.57,;2.67,-2.32,;2.69,-3.88,;1.34,-4.64,;1.34,-6.2,;,-6.98,;-1.32,-6.2,;-1.32,-4.66,;-2.66,-3.89,;-2.66,-2.32,;-1.31,-1.57,;-1.32,-.02,;-2.66,.75,;-4,-.02,;-4,-1.57,;-2.67,2.29,;-1.35,3.08,;-4.01,3.04,;-4.01,4.6,;-5.35,5.32,;-6.66,4.55,;-6.64,3.03,;-5.32,2.28,;,-3.88,;1.34,-1.57,;1.33,-.03,)|

C(C1CC1Cn1ccc(cc1)=[N+]1CCCCC1)n1ccc(cc1)=[N+]1CCCCC1 |(-2.09,-4.11,;-.75,-4.88,;.03,-6.21,;.79,-4.86,;2.12,-4.09,;2.12,-2.55,;3.45,-1.78,;3.45,-.24,;2.11,.51,;.78,-.26,;.78,-1.8,;2.11,2.05,;3.43,2.82,;3.43,4.33,;2.11,5.11,;.78,4.33,;.78,2.8,;-2.09,-2.57,;-3.42,-1.8,;-3.42,-.24,;-2.09,.53,;-.76,-.24,;-.76,-1.8,;-2.1,2.05,;-.77,2.84,;-.77,4.36,;-2.1,5.13,;-3.45,4.36,;-3.45,2.82,)|

C[N+](c1cc(Cl)cc(Cl)c1)=c1ccn(Cc2cccc(Cn3ccc(cc3)=[N+](C)c3cc(Cl)cc(Cl)c3)c2)cc1 |(-1.32,2.65,;-2.65,1.88,;-3.99,2.63,;-3.99,4.17,;-5.31,4.92,;-5.34,6.43,;-6.64,4.15,;-6.62,2.61,;-7.95,1.81,;-5.3,1.86,;-2.65,.34,;-1.31,-.43,;-1.31,-1.97,;-2.63,-2.74,;-2.63,-4.28,;-1.31,-5.05,;-1.31,-6.59,;.03,-7.36,;1.35,-6.59,;1.35,-5.05,;2.68,-4.28,;2.68,-2.73,;4.02,-1.97,;4.02,-.43,;2.68,.34,;1.34,-.44,;1.34,-1.98,;2.66,1.87,;1.34,2.63,;3.97,2.65,;3.97,4.17,;5.3,4.94,;5.3,6.46,;6.65,4.19,;6.67,2.65,;8.01,1.88,;5.33,1.87,;.03,-4.28,;-3.97,-1.97,;-3.97,-.43,)|

C[N+](c1ccccc1)=c1ccn(Cc2ccc(cc2)-c2ccc(Cn3ccc(cc3)=[N+](C)c3ccccc3)cc2)cc1 |(-9.12,2.6,;-9.17,1.07,;-10.52,.32,;-11.81,1.15,;-13.17,.43,;-13.21,-1.12,;-11.89,-1.93,;-10.57,-1.19,;-7.86,.25,;-7.91,-1.26,;-6.59,-2.07,;-5.22,-1.36,;-4.45,-2.69,;-2.92,-2.69,;-2.13,-4.02,;-.59,-4.02,;.17,-2.69,;-.59,-1.36,;-2.13,-1.36,;1.71,-2.69,;2.47,-4.02,;4.01,-4.02,;4.78,-2.69,;6.31,-2.69,;7.09,-1.36,;8.62,-1.36,;9.4,-.03,;8.62,1.3,;7.09,1.3,;6.31,-.03,;9.4,2.65,;10.93,2.65,;8.62,3.98,;9.4,5.33,;8.62,6.66,;7.09,6.66,;6.31,5.29,;7.09,3.98,;4.01,-1.35,;2.47,-1.36,;-5.18,.16,;-6.51,.98,)|

C[N+](c1ccc(Cl)cc1)=c1ccn(Cc2ccc(cc2)-c2ccc(Cn3ccc(cc3)=[N+](C)c3ccc(Cl)cc3)cc2)cc1 |(-8.94,2.54,;-9,1.01,;-10.35,.25,;-10.4,-1.28,;-11.76,-2.01,;-13.07,-1.2,;-14.43,-1.93,;-13.02,.36,;-11.68,1.07,;-7.7,.17,;-6.34,.91,;-5.01,.1,;-5.07,-1.44,;-4.27,-2.77,;-2.72,-2.77,;-1.97,-4.09,;-.43,-4.09,;.35,-2.77,;-.43,-1.44,;-1.97,-1.44,;1.88,-2.77,;2.66,-4.09,;4.2,-4.09,;4.98,-2.77,;6.52,-2.77,;7.29,-1.44,;6.52,-.1,;7.27,1.22,;8.82,1.22,;9.59,-.1,;8.82,-1.44,;9.58,2.57,;11.12,2.57,;8.81,3.9,;9.58,5.25,;8.81,6.6,;7.27,6.6,;6.49,7.88,;6.49,5.22,;7.29,3.9,;4.2,-1.43,;2.65,-1.44,;-6.42,-2.16,;-7.72,-1.34,)|

C[N+](c1ccccc1)=c1ccn(Cc2cccc(c2)-c2cccc(Cn3ccc(cc3)=[N+](C)c3ccccc3)c2)cc1 |(-11.04,1.1,;-9.69,1.83,;-9.62,3.35,;-8.27,4.07,;-8.2,5.61,;-9.5,6.44,;-10.86,5.71,;-10.92,4.17,;-8.39,1.01,;-8.44,-.53,;-7.12,-1.35,;-5.76,-.64,;-4.22,-.61,;-3.44,-1.95,;-4.2,-3.28,;-3.44,-4.62,;-1.9,-4.62,;-1.13,-3.28,;-1.9,-1.95,;.41,-3.28,;1.18,-4.62,;2.71,-4.62,;3.48,-3.28,;2.71,-1.94,;3.48,-.6,;5,-.6,;5.78,-1.93,;7.32,-1.93,;8.09,-.58,;7.3,.76,;5.75,.74,;9.63,-.58,;10.41,-1.91,;10.39,.76,;11.91,.76,;12.65,2.07,;11.9,3.39,;10.36,3.37,;9.61,2.04,;1.17,-1.95,;-5.7,.89,;-7.02,1.73,)|

C[N+](c1cc(Cl)cc(Cl)c1)=c1ccn(CC2CC2Cn2ccc(cc2)=[N+](C)c2cc(Cl)cc(Cl)c2)cc1 |(.78,2.12,;2.12,1.35,;3.45,2.12,;4.79,1.35,;6.12,2.12,;7.45,1.35,;6.11,3.66,;4.77,4.43,;4.76,5.97,;3.43,3.63,;2.12,-.19,;3.46,-.96,;3.46,-2.5,;2.12,-3.25,;2.15,-4.79,;.8,-5.58,;.05,-6.91,;-.74,-5.58,;-2.08,-4.81,;-2.08,-3.27,;-.74,-2.5,;-.75,-.96,;-2.08,-.17,;-3.41,-.96,;-3.41,-2.5,;-2.09,1.35,;-.76,2.12,;-3.42,2.12,;-3.42,3.66,;-4.76,4.43,;-4.78,5.97,;-6.09,3.63,;-6.09,2.09,;-7.41,1.32,;-4.75,1.35,;.8,-2.5,;.79,-.96,)|

C[N+](c1cc(Cl)cc(Cl)c1)=c1ccn(Cc2ccc(Cn3ccc(cc3)=[N+](C)c3cc(Cl)cc(Cl)c3)cc2)cc1 |(-6.66,2.21,;-6.68,.67,;-8.01,-.08,;-9.32,.72,;-10.65,-.03,;-11.97,.74,;-10.68,-1.57,;-9.37,-2.35,;-9.37,-3.89,;-8.04,-1.6,;-5.35,-.12,;-5.39,-1.67,;-4.06,-2.46,;-2.7,-1.71,;-1.93,-3.05,;-.39,-3.05,;.38,-4.37,;1.93,-4.37,;2.7,-3.04,;4.24,-3.04,;4.99,-1.71,;3.66,-.97,;3.66,.58,;4.99,1.37,;6.32,.6,;6.32,-.94,;4.99,2.89,;3.63,3.67,;6.32,3.69,;6.3,5.21,;7.63,5.98,;7.63,7.51,;8.99,5.23,;8.99,3.69,;10.32,2.91,;7.65,2.89,;1.93,-1.71,;.38,-1.71,;-2.68,-.17,;-4.01,.62,)|

C\[N+](c1ccccc1)=c1\ccn(Cc2ccc(cc2)-c2ccc(Cn3cc\c(=[N+](/C)c4ccccc4)c4ccccc34)cc2)c2ccccc12

Cc1c(N)ccc2c1n(Cc1ccc(CCc3ccc(Cn4cc\c(=[N+](/C)c5ccccc5)c5ccc(N)c(C)c45)cc3)cc1)cc\c2=[N+](\C)c1ccccc1

C\[N+](c1ccc(Cl)cc1)=c1\ccn(Cc2ccc(CCc3ccc(Cn4cc\c(=[N+](/C)c5ccc(Cl)cc5)c5ccccc45)cc3)cc2)c2ccccc12

C\[N+](c1ccccc1)=c1\ccn(Cc2ccc(CCc3ccc(Cn4cc\c(=[N+](/C)c5ccccc5)c5ccccc45)cc3)cc2)c2ccccc12

Clc1ccc2c(c1)n(Cc1ccc(cc1)-c1ccc(Cn3ccc(=[N+]4CCCC4)c4ccc(Cl)cc34)cc1)ccc2=[N+]1CCCC1 |(-7.5,-3.8,;-6.2,-2.99,;-6.24,-1.45,;-4.94,-.63,;-3.58,-1.34,;-3.52,-2.88,;-4.83,-3.71,;-2.16,-3.6,;-2.1,-5.14,;-.74,-5.86,;-.02,-7.21,;1.52,-7.25,;2.34,-5.92,;1.59,-4.58,;.07,-4.56,;3.88,-5.95,;4.62,-7.3,;6.14,-7.33,;6.95,-6.02,;8.26,-5.21,;8.23,-3.67,;6.88,-2.94,;6.84,-1.38,;8.16,-.59,;8.12,.95,;9.34,1.88,;8.82,3.34,;7.28,3.3,;6.84,1.82,;9.5,-1.34,;10.82,-.54,;12.16,-1.27,;12.2,-2.81,;13.56,-3.55,;10.9,-3.62,;9.55,-2.88,;6.19,-4.66,;4.66,-4.64,;-.85,-2.78,;-.92,-1.24,;-2.28,-.52,;-2.35,1.02,;-3.63,1.86,;-3.21,3.35,;-1.67,3.41,;-1.14,1.97,)|

[NH2+]=c1ccn(Cc2cccc(c2)-c2cccc(Cn3ccc(=[NH2+])c4ccccc34)c2)c2ccccc12

[NH2+]=c1ccn(Cc2ccc(cc2)-c2ccc(Cn3ccc(=[NH2+])c4ccccc34)cc2)c2ccccc12

C[N+](C)=c1ccn(Cc2cccc(c2)-c2cccc(Cn3ccc(=[N+](C)C)c4ccc(Cl)cc34)c2)c2cc(Cl)ccc12 |(-4.13,5.6,;-2.77,4.89,;-1.46,5.71,;-2.7,3.35,;-1.34,2.64,;-1.27,1.09,;-2.58,.27,;-2.52,-1.27,;-1.16,-1.99,;-1.97,-3.29,;-1.24,-4.64,;.3,-4.67,;1.1,-3.36,;.36,-2.01,;2.64,-3.38,;3.38,-4.73,;4.92,-4.77,;5.72,-3.44,;4.97,-2.1,;6.28,-1.29,;6.23,.25,;4.88,.98,;4.86,2.53,;6.16,3.33,;6.13,4.87,;7.45,5.68,;4.79,5.61,;7.52,2.59,;8.82,3.38,;10.18,2.65,;10.22,1.11,;11.57,.37,;8.91,.3,;7.56,1.04,;3.44,-2.06,;-3.94,.99,;-5.25,.16,;-6.62,.89,;-7.92,.07,;-6.66,2.43,;-5.36,3.24,;-4,2.53,)|

C(c1ccc(cc1)-c1ccc(Cn2cc\c(=[NH+]/c3ccccc3)c3ccccc23)cc1)n1cc\c(=[NH+]\c2ccccc2)c2ccccc12

C(c1cccc(c1)-c1cccc(Cn2cc\c(=[NH+]/c3ccccc3)c3ccccc23)c1)n1cc\c(=[NH+]\c2ccccc2)c2ccccc12

C(c1cccc(c1)-c1cccc(Cn2ccc(=[N+]3CCCCCC3)c3ccccc23)c1)n1ccc(=[N+]2CCCCCC2)c2ccccc12 |(-4.01,-2.08,;-2.68,-2.85,;-3.45,-4.18,;-2.7,-5.51,;-1.16,-5.53,;-.37,-4.18,;-1.14,-2.85,;1.15,-4.18,;1.92,-5.51,;3.46,-5.51,;4.23,-4.18,;3.46,-2.85,;4.74,-2.01,;4.67,-.47,;3.31,.23,;3.25,1.79,;4.55,2.61,;4.48,4.15,;5.84,4.88,;6.11,6.41,;5.09,7.54,;3.55,7.47,;2.64,6.25,;3.06,4.75,;5.91,1.89,;7.21,2.72,;8.57,2.01,;8.64,.47,;7.35,-.36,;5.98,.35,;1.92,-2.85,;-4.01,-.54,;-2.68,.23,;-2.7,1.77,;-4.03,2.54,;-4.05,4.08,;-2.66,4.76,;-2.35,6.27,;-3.33,7.46,;-4.85,7.44,;-5.8,6.22,;-5.43,4.73,;-5.36,1.77,;-6.69,2.52,;-8.02,1.75,;-8.02,.2,;-6.69,-.57,;-5.36,.21,)|

Cc1c(N)ccc2c1n(Cc1ccc(CCc3ccc(Cn4cc\c(=[N+](/C)c5ccc(Cl)cc5)c5ccc(N)c(C)c45)cc3)cc1)cc\c2=[N+](\C)c1ccc(Cl)cc1

C(Cc1ccc(Cn2cc\c(=[NH+]/c3ccccc3)c3ccccc23)cc1)c1ccc(Cn2cc\c(=[NH+]\c3ccccc3)c3ccccc23)cc1

Clc1ccc2c(c1)n(Cc1cccc(c1)-c1cccc(Cn3ccc(=[NH2+])c4ccc(Cl)cc34)c1)ccc2=[NH2+]

Clc1ccc2c(c1)n(Cc1ccc(cc1)-c1ccc(Cn3ccc(=[NH2+])c4ccc(Cl)cc34)cc1)ccc2=[NH2+]

Clc1ccc2c(c1)n(Cc1ccc(CCc3ccc(Cn4ccc(=[N+]5CCCC5)c5ccc(Cl)cc45)cc3)cc1)ccc2=[N+]1CCCC1 |(18.29,-4.32,;16.94,-3.58,;16.89,-2.04,;15.54,-1.31,;14.23,-2.11,;14.27,-3.65,;15.63,-4.39,;12.95,-4.44,;12.99,-5.98,;11.67,-6.79,;10.92,-5.43,;9.38,-5.41,;8.61,-6.72,;7.07,-6.69,;6.33,-5.35,;4.79,-5.3,;4.04,-3.96,;2.52,-3.95,;1.71,-5.25,;.35,-4.52,;.29,-2.99,;1.59,-2.17,;1.52,-.61,;.17,.09,;.1,1.62,;-1.18,2.47,;-.76,3.96,;.78,4.03,;1.31,2.58,;-1.13,-.73,;-2.49,-.01,;-3.79,-.82,;-3.75,-2.36,;-5.05,-3.18,;-2.38,-3.09,;-1.07,-2.27,;2.43,-6.6,;3.97,-6.63,;9.34,-8.05,;10.88,-8.1,;11.6,-3.71,;11.58,-2.15,;12.88,-1.36,;12.85,.18,;14.07,1.1,;13.56,2.56,;12.02,2.52,;11.58,1.04,)|

Cc1c(N)ccc2c1n(Cc1cccc(c1)-c1cccc(Cn3cc\c(=[N+](/C)c4ccc(Cl)cc4)c4ccc(N)c(C)c34)c1)cc\c2=[N+](\C)c1ccc(Cl)cc1

C(c1ccc(cc1)-c1ccc(Cn2ccc(=[N+]3CCCCCC3)c3ccccc23)cc1)n1ccc(=[N+]2CCCCCC2)c2ccccc12 |(-3.14,-3.12,;-1.73,-3.73,;-.99,-5.08,;.54,-5.11,;1.35,-3.8,;.61,-2.46,;-.92,-2.42,;2.88,-3.83,;3.67,-2.52,;5.21,-2.54,;5.95,-3.89,;7.27,-3.1,;7.24,-1.56,;5.88,-.82,;5.85,.74,;7.17,1.53,;7.12,3.07,;5.74,3.7,;5.35,5.19,;6.27,6.43,;7.81,6.46,;8.8,5.28,;8.51,3.77,;8.51,.78,;9.82,1.58,;11.18,.85,;11.21,-.7,;9.89,-1.5,;8.54,-.75,;5.16,-5.21,;3.62,-5.18,;-3.33,-1.59,;-2.09,-.68,;-2.28,.86,;-3.68,1.46,;-3.89,3,;-5.33,3.49,;-5.87,4.94,;-5.07,6.26,;-3.54,6.45,;-2.42,5.38,;-2.58,3.84,;-4.91,.55,;-6.33,1.14,;-7.55,.23,;-7.38,-1.31,;-5.97,-1.92,;-4.73,-.99,)|

C\[N+](c1ccccc1)=c1\ccn(Cc2cccc(c2)-c2cccc(Cn3cc\c(=[N+](/C)c4ccccc4)c4ccc(Cl)cc34)c2)c2cc(Cl)ccc12

Clc1ccc2c(c1)n(Cc1ccc(CCc3ccc(Cn4ccc(=[NH2+])c5ccc(Cl)cc45)cc3)cc1)ccc2=[NH2+]

Cc1c(N)ccc2c1n(Cc1ccc(cc1)-c1ccc(Cn3cc\c(=[N+](/C)c4ccccc4)c4ccc(N)c(C)c34)cc1)cc\c2=[N+](\C)c1ccccc1

[NH2+]=c1ccn(Cc2ccc(CCc3ccc(Cn4ccc(=[NH2+])c5ccccc45)cc3)cc2)c2ccccc12

C[N+](C)=c1ccn(Cc2ccc(cc2)-c2ccc(Cn3ccc(=[N+](C)C)c4ccc(Cl)cc34)cc2)c2cc(Cl)ccc12 |(-1.04,1.83,;-2.35,1.02,;-3.71,1.73,;-2.28,-.52,;-.93,-1.24,;-.86,-2.78,;-2.16,-3.6,;-2.1,-5.14,;-.74,-5.86,;-.02,-7.21,;1.52,-7.25,;2.34,-5.92,;1.59,-4.58,;.07,-4.56,;3.88,-5.95,;4.62,-7.3,;6.14,-7.33,;6.95,-6.02,;8.26,-5.21,;8.23,-3.67,;6.88,-2.94,;6.84,-1.38,;8.16,-.59,;8.12,.95,;9.43,1.75,;6.77,1.68,;9.5,-1.34,;10.82,-.54,;12.16,-1.27,;12.2,-2.81,;13.56,-3.55,;10.9,-3.62,;9.55,-2.88,;6.19,-4.66,;4.66,-4.64,;-3.52,-2.88,;-4.83,-3.71,;-6.2,-2.99,;-7.5,-3.8,;-6.24,-1.45,;-4.94,-.63,;-3.58,-1.34,)|

Cc1cn(Cc2cccc(c2)-c2cccc(Cn3cc(C)c(=[NH2+])c4ccccc34)c2)c2ccccc2c1=[NH2+]

C\[N+](c1ccccc1)=c1\ccn(Cc2ccc(cc2)-c2ccc(Cn3cc\c(=[N+](/C)c4ccccc4)c4ccc(Cl)cc34)cc2)c2cc(Cl)ccc12

Clc1ccc2c(c1)n(Cc1cccc(c1)-c1cccc(Cn3ccc(=[N+]4CCCC4)c4ccc(Cl)cc34)c1)ccc2=[N+]1CCCC1 |(-7.92,.07,;-6.62,.89,;-6.66,2.43,;-5.36,3.24,;-4,2.53,;-3.94,.99,;-5.25,.16,;-2.58,.27,;-2.52,-1.27,;-1.16,-1.99,;-1.97,-3.29,;-1.24,-4.64,;.3,-4.67,;1.1,-3.36,;.36,-2.01,;2.64,-3.38,;3.38,-4.73,;4.92,-4.77,;5.72,-3.44,;4.97,-2.1,;6.28,-1.29,;6.23,.25,;4.88,.98,;4.86,2.53,;6.16,3.33,;6.13,4.87,;7.35,5.8,;6.84,7.27,;5.3,7.22,;4.86,5.75,;7.52,2.59,;8.82,3.38,;10.18,2.65,;10.22,1.11,;11.57,.37,;8.91,.3,;7.56,1.04,;3.44,-2.06,;-1.27,1.09,;-1.34,2.64,;-2.7,3.35,;-2.77,4.89,;-4.05,5.73,;-3.63,7.22,;-2.09,7.28,;-1.55,5.85,)|

C(Cc1ccc(Cn2ccc(=[N+]3CCCCCC3)c3ccccc23)cc1)c1ccc(Cn2ccc(=[N+]3CCCCCC3)c3ccccc23)cc1 |(3.57,-5.32,;2.82,-3.97,;1.28,-3.94,;.54,-2.6,;-1,-2.57,;-1.8,-3.87,;-3.21,-3.27,;-3.4,-1.73,;-2.16,-.82,;-2.35,.72,;-3.76,1.32,;-3.96,2.86,;-5.4,3.35,;-5.94,4.82,;-5.15,6.13,;-3.61,6.31,;-2.5,5.24,;-2.65,3.7,;-4.98,.41,;-6.41,1,;-7.64,.09,;-7.46,-1.45,;-6.04,-2.06,;-4.81,-1.13,;-1.07,-5.23,;.47,-5.26,;5.11,-5.35,;5.84,-6.7,;7.38,-6.73,;8.17,-5.41,;9.49,-4.62,;9.46,-3.08,;8.1,-2.34,;8.07,-.78,;9.39,.02,;9.34,1.56,;7.95,2.19,;7.57,3.68,;8.49,4.91,;10.03,4.95,;11.02,3.77,;10.73,2.26,;10.73,-.73,;12.05,.06,;13.4,-.66,;13.44,-2.22,;12.12,-3.02,;10.76,-2.27,;7.43,-4.06,;5.89,-4.04,)|

C[N+](C)=c1ccn(Cc2ccc(cc2)-c2ccc(Cn3ccc(=[N+](C)C)c4ccccc34)cc2)c2ccccc12 |(-5.3,3.61,;-3.89,3,;-2.65,3.92,;-3.69,1.46,;-2.28,.86,;-2.09,-.68,;-3.33,-1.59,;-3.14,-3.13,;-1.73,-3.73,;-1,-5.09,;.54,-5.12,;1.35,-3.8,;.61,-2.46,;-.93,-2.43,;2.88,-3.83,;3.67,-2.52,;5.21,-2.54,;5.96,-3.9,;7.28,-3.1,;7.24,-1.56,;5.89,-.82,;5.86,.74,;7.17,1.53,;7.12,3.07,;8.45,3.86,;5.79,3.82,;8.51,.79,;9.83,1.58,;11.18,.86,;11.22,-.7,;9.9,-1.5,;8.55,-.75,;5.16,-5.21,;3.62,-5.19,;-4.74,-.99,;-5.97,-1.92,;-7.39,-1.31,;-7.56,.23,;-6.34,1.14,;-4.91,.55,)|

Cc1c(N)ccc2c1n(Cc1ccc(cc1)-c1ccc(Cn3cc\c(=[N+](/C)c4ccc(Cl)cc4)c4ccc(N)c(C)c34)cc1)cc\c2=[N+](\C)c1ccc(Cl)cc1

Cc1c(N)ccc2c1n(Cc1cccc(c1)-c1cccc(Cn3cc\c(=[N+](/C)c4ccccc4)c4ccc(N)c(C)c34)c1)cc\c2=[N+](\C)c1ccccc1

C\[N+](c1ccc(Cl)cc1)=c1\ccn(Cc2ccc(cc2)-c2ccc(Cn3cc\c(=[N+](/C)c4ccc(Cl)cc4)c4ccc(Cl)cc34)cc2)c2cc(Cl)ccc12

C[N+](C)=c1ccn(Cc2cccc(c2)-c2cccc(Cn3ccc(=[N+](C)C)c4ccccc34)c2)c2ccccc12 |(5.78,5.2,;4.49,4.38,;3.12,5.09,;4.56,2.84,;3.26,2.03,;3.32,.46,;4.68,-.24,;4.75,-1.78,;3.47,-2.62,;4.24,-3.96,;3.47,-5.29,;1.92,-5.29,;1.15,-3.96,;1.92,-2.62,;-.37,-3.96,;-1.16,-5.3,;-2.7,-5.29,;-3.46,-3.96,;-2.68,-2.62,;-4.02,-1.85,;-4.02,-.31,;-2.69,.46,;-2.7,2,;-4.03,2.77,;-4.06,4.31,;-5.39,5.07,;-2.73,5.09,;-5.37,2,;-6.7,2.76,;-8.03,1.99,;-8.03,.44,;-6.7,-.34,;-5.37,.44,;-1.14,-2.62,;5.99,.58,;7.36,-.12,;8.65,.7,;8.58,2.24,;7.22,2.96,;5.92,2.13,)|

C[N+](C)=c1ccn(Cc2ccc(CCc3ccc(Cn4ccc(=[N+](C)C)c5ccc(Cl)cc45)cc3)cc2)c2cc(Cl)ccc12 |(-.91,2.29,;.45,1.58,;1.76,2.39,;.52,.04,;1.87,-.68,;1.94,-2.22,;.64,-3.04,;.7,-4.58,;2.06,-5.3,;2.87,-4,;4.39,-4.02,;5.14,-5.36,;6.68,-5.4,;7.42,-6.75,;8.96,-6.77,;9.73,-5.47,;11.27,-5.49,;12.02,-6.84,;13.34,-6.04,;13.3,-4.5,;11.95,-3.76,;11.93,-2.22,;13.23,-1.42,;13.2,.12,;14.52,.93,;11.86,.86,;14.59,-2.15,;15.89,-1.36,;17.24,-2.1,;17.29,-3.64,;18.64,-4.37,;15.98,-4.44,;14.62,-3.69,;11.23,-8.16,;9.69,-8.12,;4.32,-6.69,;2.78,-6.66,;-.72,-2.32,;-2.03,-3.15,;-3.4,-2.43,;-4.7,-3.24,;-3.44,-.89,;-2.14,-.05,;-.79,-.78,)|

C\[N+](c1ccccc1)=c1\ccn(Cc2cccc(c2)-c2cccc(Cn3cc\c(=[N+](/C)c4ccccc4)c4ccccc34)c2)c2ccccc12

C\[N+](c1ccc(Cl)cc1)=c1\ccn(Cc2cccc(c2)-c2cccc(Cn3cc\c(=[N+](/C)c4ccc(Cl)cc4)c4ccc(Cl)cc34)c2)c2cc(Cl)ccc12

C[N+](C)=c1ccn(Cc2ccc(CCc3ccc(Cn4ccc(=[N+](C)C)c5ccccc45)cc3)cc2)c2ccccc12 |(-2.72,3.79,;-3.96,2.86,;-5.37,3.45,;-3.76,1.32,;-2.35,.72,;-2.16,-.82,;-3.4,-1.73,;-3.21,-3.27,;-1.8,-3.87,;-1,-2.57,;.54,-2.6,;1.28,-3.94,;2.82,-3.97,;3.57,-5.32,;5.11,-5.35,;5.84,-6.7,;7.38,-6.73,;8.17,-5.41,;9.49,-4.62,;9.46,-3.08,;8.1,-2.34,;8.07,-.78,;9.39,.02,;9.34,1.56,;10.66,2.35,;7.99,2.29,;10.73,-.73,;12.05,.06,;13.4,-.66,;13.44,-2.22,;12.12,-3.02,;10.76,-2.27,;7.43,-4.06,;5.89,-4.04,;.47,-5.26,;-1.07,-5.23,;-4.81,-1.13,;-6.04,-2.06,;-7.46,-1.45,;-7.64,.09,;-6.41,1,;-4.98,.41,)|

Cc1cn(Cc2ccc(cc2)-c2ccc(Cn3cc(C)c(=[NH2+])c4ccccc34)cc2)c2ccccc2c1=[NH2+]

C\[N+](c1ccc(Cl)cc1)=c1\ccn(Cc2cccc(c2)-c2cccc(Cn3cc\c(=[N+](/C)c4ccc(Cl)cc4)c4ccccc34)c2)c2ccccc12

C\[N+](c1ccc(Cl)cc1)=c1\ccn(Cc2ccc(CCc3ccc(Cn4cc\c(=[N+](/C)c5ccc(Cl)cc5)c5ccc(Cl)cc45)cc3)cc2)c2cc(Cl)ccc12

C\[N+](c1ccccc1)=c1\ccn(Cc2ccc(CCc3ccc(Cn4cc\c(=[N+](/C)c5ccccc5)c5ccc(Cl)cc45)cc3)cc2)c2cc(Cl)ccc12

Clc1ccc2c(cc[n+](Cc3ccc(SCCSc4ccc(C[n+]5ccc(N6CCCC6)c6ccc(Cl)cc56)cc4)cc3)c2c1)N1CCCC1

C(CSc1ccc(C[n+]2ccc(N3CCCCC3)c3ccsc23)cc1)Sc1ccc(C[n+]2ccc(N3CCCCC3)c3ccsc23)cc1

C(CSc1ccc(C[n+]2ccc(N3CCCCCC3)c3ccsc23)cc1)Sc1ccc(C[n+]2ccc(N3CCCCCC3)c3ccsc23)cc1

C(CSc1ccc(C[n+]2ccc(N3CCCC3)c3sccc23)cc1)Sc1ccc(C[n+]2ccc(N3CCCC3)c3sccc23)cc1

CN(c1ccccc1)c1nc[n+](Cc2ccc(SCCSc3ccc(C[n+]4cnc(N(C)c5ccccc5)c5sccc45)cc3)cc2)c2ccsc12

C(CSc1ccc(C[n+]2cnc(N3CCCC3)c3sccc23)cc1)Sc1ccc(C[n+]2cnc(N3CCCC3)c3sccc23)cc1

C(CSc1ccc(C[n+]2ccc(N3CCCCCC3)c3sccc23)cc1)Sc1ccc(C[n+]2ccc(N3CCCCCC3)c3sccc23)cc1

CN(c1ccccc1)c1cc[n+](Cc2ccc(SCCSc3ccc(C[n+]4ccc(N(C)c5ccccc5)c5ccccc45)cc3)cc2)c2ccccc12

CN(c1ccccc1)c1cc[n+](Cc2ccc(SCCSc3ccc(C[n+]4ccc(N(C)c5ccccc5)c5ccsc45)cc3)cc2)c2sccc12

CN(c1ccc(Cl)cc1)c1cc[n+](Cc2ccc(SCCSc3ccc(C[n+]4ccc(N(C)c5ccc(Cl)cc5)c5ccccc45)cc3)cc2)c2ccccc12

CN(c1ccc(Cl)cc1)c1cc[n+](Cc2ccc(SCCSc3ccc(C[n+]4ccc(N(C)c5ccc(Cl)cc5)c5ccsc45)cc3)cc2)c2sccc12

C(c1ccc(SSc2ccc(C[n+]3ccc(cc3)N3CCCC3)cc2)cc1)[n+]1ccc(cc1)N1CCCC1

C(c1ccc(SSc2ccc(C[n+]3cnc(N4CCCCCC4)c4ccsc34)cc2)cc1)[n+]1cnc(N2CCCCCC2)c2ccsc12

C(c1ccc(SSc2ccc(C[n+]3cnc(N4CCCCC4)c4ccsc34)cc2)cc1)[n+]1cnc(N2CCCCC2)c2ccsc12

Clc1ccc2c(cc[n+](Cc3ccc(SSc4ccc(C[n+]5ccc(N6CCCC6)c6ccc(Cl)cc56)cc4)cc3)c2c1)N1CCCC1

CN(c1ccc(Cl)cc1)c1cc[n+](Cc2ccc(SSc3ccc(C[n+]4ccc(N(C)c5ccc(Cl)cc5)c5ccccc45)cc3)cc2)c2ccccc12

C(c1ccc(SSc2ccc(C[n+]3ccc(N4CCCC4)c4sccc34)cc2)cc1)[n+]1ccc(N2CCCC2)c2sccc12

CN(C)c1cc[n+](Cc2ccc(SSc3ccc(C[n+]4ccc(cc4)N(C)C)cc3)cc2)cc1

C(c1ccc(SSc2ccc(C[n+]3cnc(N4CCCC4)c4sccc34)cc2)cc1)[n+]1cnc(N2CCCC2)c2sccc12

COc1cc2CC[N+](Cc2cc1OC)=c1ccn(Cc2ccc(Cn3ccc(cc3)=[N+]3CCCCC3)cc2)cc1 |(22.64,-11.65,;21.3,-10.89,;19.97,-11.67,;18.64,-10.91,;17.31,-11.67,;15.97,-10.91,;14.64,-11.68,;14.66,-13.22,;15.99,-13.99,;17.31,-13.21,;18.64,-13.98,;19.97,-13.21,;21.31,-13.98,;22.64,-13.2,;13.33,-14,;13.34,-15.54,;12.01,-16.32,;10.67,-15.55,;9.34,-16.33,;8,-15.57,;6.67,-16.34,;5.33,-15.58,;5.33,-14.04,;4,-13.27,;2.66,-14.05,;2.67,-15.6,;1.33,-16.37,;-0,-15.6,;-0,-14.06,;1.33,-13.29,;-1.34,-16.37,;-2.67,-15.59,;-4,-16.35,;-4.01,-17.9,;-2.67,-18.67,;-1.33,-17.91,;6.65,-13.26,;7.99,-14.02,;10.66,-14.02,;11.98,-13.24,)|

CN(C)C(=O)C[n+]1ccc(cc1)-c1nc(oc1C(F)(F)F)-c1ccc(cc1)C(c1ccc(cc1)-c1nc(c(o1)C(F)(F)F)-c1cc[n+](CC(=O)N(C)C)cc1)(C(F)(F)F)C(F)(F)F

CN(C)C(=O)C[n+]1ccc(cc1)-c1nc(oc1C(F)(F)F)-c1ccc(cc1)-c1nc(c(o1)C(F)(F)F)-c1cc[n+](CC(=O)N(C)C)cc1

CN(C)C(=O)C[n+]1ccc(cc1)-c1nc(oc1C(F)(F)C(F)(F)F)-c1ccc(cc1)-c1nc(c(o1)C(F)(F)C(F)(F)F)-c1cc[n+](CC(=O)N(C)C)cc1

OCC[n+]1ccc(cc1)-c1nc(oc1C(F)(F)C(F)(F)F)-c1ccc(cc1)-c1ccc(cc1)-c1nc(c(o1)C(F)(F)C(F)(F)F)-c1cc[n+](CCO)cc1

OCC[n+]1ccc(cc1)-c1nc(oc1C(F)(F)F)-c1ccc(cc1)-c1ccc(cc1)-c1nc(c(o1)C(F)(F)F)-c1cc[n+](CCO)cc1

OCC[n+]1ccc(cc1)-c1nc(oc1C(F)(F)C(F)(F)C(F)(F)F)-c1ccc(cc1)-c1ccc(cc1)-c1nc(c(o1)C(F)(F)C(F)(F)C(F)(F)F)-c1cc[n+](CCO)cc1

CN(C)C(=O)C[n+]1ccc(cc1)-c1nc(oc1C(F)(F)C(F)(F)C(F)(F)F)-c1ccc(cc1)-c1ccc(cc1)-c1nc(c(o1)C(F)(F)C(F)(F)C(F)(F)F)-c1cc[n+](CC(=O)N(C)C)cc1

CN(C)C(=O)C[n+]1ccc(cc1)-c1nc(oc1C(F)(F)C(F)(F)F)-c1ccc(cc1)-c1ccc(cc1)-c1nc(c(o1)C(F)(F)C(F)(F)F)-c1cc[n+](CC(=O)N(C)C)cc1

CN(C)C(=O)C[n+]1ccc(cc1)-c1nc(oc1C(F)(F)F)-c1ccc(cc1)-c1ccc(cc1)-c1nc(c(o1)C(F)(F)F)-c1cc[n+](CC(=O)N(C)C)cc1

OCC[n+]1ccc(cc1)-c1nc(oc1C(F)(F)C(F)(F)F)-c1ccc(cc1)C(c1ccc(cc1)-c1nc(c(o1)C(F)(F)C(F)(F)F)-c1cc[n+](CCO)cc1)(C(F)(F)F)C(F)(F)F

OCC[n+]1ccc(cc1)-c1nc(oc1C(F)(F)C(F)(F)C(F)(F)F)-c1ccc(cc1)C(c1ccc(cc1)-c1nc(c(o1)C(F)(F)C(F)(F)C(F)(F)F)-c1cc[n+](CCO)cc1)(C(F)(F)F)C(F)(F)F

FC(F)(F)C(F)(F)c1oc(nc1-c1cc[n+](CCCl)cc1)-c1ccc(cc1)C(c1ccc(cc1)-c1nc(c(o1)C(F)(F)C(F)(F)F)-c1cc[n+](CCCl)cc1)(C(F)(F)F)C(F)(F)F

FC(F)(F)c1oc(nc1-c1cc[n+](CCCl)cc1)-c1ccc(cc1)C(c1ccc(cc1)-c1nc(c(o1)C(F)(F)F)-c1cc[n+](CCCl)cc1)(C(F)(F)F)C(F)(F)F

FC(F)(F)C(F)(F)C(F)(F)c1oc(nc1-c1cc[n+](CCCl)cc1)-c1ccc(cc1)C(c1ccc(cc1)-c1nc(c(o1)C(F)(F)C(F)(F)C(F)(F)F)-c1cc[n+](CCCl)cc1)(C(F)(F)F)C(F)(F)F

C[N+](C)=c1ccn(Cc2ccc(cc2)-c2ccc(Cn3ccc(cc3)=[N+](C)c3ccc(Cl)cc3)cc2)cc1 |(47.44,-34.69,;48.98,-34.75,;49.78,-33.44,;49.75,-36.09,;51.29,-36.09,;52.06,-37.42,;51.28,-38.75,;52.05,-40.09,;53.59,-40.09,;54.36,-41.42,;55.9,-41.43,;56.67,-40.09,;55.89,-38.75,;54.35,-38.76,;58.21,-40.09,;58.97,-41.43,;60.51,-41.42,;61.28,-40.09,;62.82,-40.09,;63.59,-41.42,;62.82,-42.75,;63.59,-44.08,;65.13,-44.08,;65.9,-42.73,;65.13,-41.41,;65.91,-45.41,;65.14,-46.75,;67.45,-45.41,;68.21,-46.74,;69.75,-46.74,;70.52,-45.4,;72.06,-45.39,;69.74,-44.07,;68.2,-44.08,;60.5,-38.75,;58.96,-38.76,;49.75,-38.76,;48.98,-37.43,)|

C[N+](C)=c1ccn(Cc2ccc(CCCCc3ccc(Cn4ccc(cc4)=[N+](C)c4ccc(Cl)cc4)cc3)cc2)cc1 |(32.88,-47.23,;34.42,-47.29,;35.21,-45.97,;35.19,-48.62,;36.73,-48.62,;37.5,-49.95,;36.72,-51.28,;37.49,-52.62,;39.03,-52.62,;39.8,-53.96,;41.34,-53.96,;42.11,-52.62,;43.65,-52.62,;44.42,-53.95,;45.96,-53.95,;46.73,-55.28,;48.27,-55.29,;49.03,-56.63,;50.57,-56.63,;51.34,-55.3,;52.88,-55.3,;53.65,-56.64,;52.87,-57.96,;53.64,-59.3,;55.18,-59.3,;55.95,-57.96,;55.18,-56.63,;55.95,-60.63,;55.16,-61.95,;57.5,-60.69,;58.21,-62.06,;59.75,-62.12,;60.58,-60.82,;62.12,-60.87,;59.85,-59.44,;58.31,-59.39,;50.57,-53.96,;49.03,-53.96,;41.33,-51.28,;39.79,-51.29,;35.19,-51.29,;34.42,-49.96,)|

C[N+](C)=c1ccn(Cc2ccc(CCc3ccc(Cn4ccc(cc4)=[N+]4CCCC4)cc3)cc2)cc1 |(47.93,.23,;47.16,-1.11,;45.62,-1.11,;47.93,-2.44,;49.47,-2.44,;50.24,-3.78,;49.46,-5.11,;50.23,-6.44,;51.77,-6.44,;52.54,-7.78,;54.07,-7.78,;54.85,-6.44,;56.39,-6.44,;57.16,-7.78,;58.69,-7.77,;59.45,-9.11,;60.99,-9.12,;61.77,-7.78,;63.31,-7.79,;64.07,-9.12,;63.3,-10.45,;64.06,-11.78,;65.61,-11.79,;66.38,-10.44,;65.61,-9.12,;66.37,-13.12,;65.85,-14.56,;67.06,-15.52,;68.34,-14.66,;67.92,-13.18,;60.99,-6.44,;59.45,-6.45,;54.07,-5.11,;52.53,-5.11,;47.93,-5.11,;47.16,-3.78,)|

CN1CCCN(CC1)Cc2ccc(cc2)CN

CN1CCCN(CC1)c1ccc(CO)cc1

O=C(N1CCNCC1)N1CCCCCC1

c1c(ncnc1N)C(F)(F)F

CN1CCNCC(Cc2ccc3ncccc3c2)C1

CN1CCCN(CC1)Cc2ccc3c(c2)cccn3

CN1CCCN(Cc2ccc3ccccc3c2)CC1

CN1CCCN(Cc2ccc(cc2)-c2ccccc2)CC1

CN1CCN(CC1)c1ccc(cc1)-c1ccc(CN2CCCN(C)CC2)cc1

COC(=O)c1ccc(cc1)-c1ccc(CN2CCCN(C)CC2)cc1

COc1ccc(cc1)-c1ccc(CN2CCCN(C)CC2)cc1

CN1CCCN(Cc2ccc(cc2)-c2ccc(cc2)C(F)(F)F)CC1

CN1CCCN(Cc2ccc(cc2)-c2ccc(cc2)C(=O)N2CCCN(C)CC2)CC1

CN1CCCN(Cc2ccc(cc2)-c2ccc(CN3CCCN(C)CC3)cc2)CC1

CN1CCCN(Cc2ccc(cc2)-c2ccc(CN3CCCN(C)CC3)cc2C#N)CC1

CN1CCCN(Cc2ccc(cc2)-c2ccc(CN3CCCN(C)CC3)c(F)c2F)CC1

CN1CCCN(Cc2ccc(c(F)c2)-c2ccc(CN3CCCN(C)CC3)cc2C#N)CC1

CN1CCCN(Cc2ccc(cc2)-c2ccc(CN3CCCN(C)CC3)c(Cl)c2)CC1

CN1CCCN(Cc2ccc(cc2)-c2ccc(CN3CCCN(C)CC3)cc2F)CC1

CN1CCCN(Cc2ccc(cc2)-c2cc(F)c(CN3CCCN(C)CC3)c(F)c2)CC1

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