ATOM 26
1 C1z C 21.6025 -15.2484
2 C1y C 21.6551 -16.6539
3 C1y C 23.0077 -14.8384
4 C1x C 20.4662 -14.5399
5 C1x C 20.8702 -14.1007
6 C1y C 20.4428 -17.3332
7 C1x C 22.9843 -17.1048
8 C1x C 23.8217 -15.9745
9 C1y C 23.0311 -13.4389
10 C1x C 19.2481 -15.2250
11 N1y N 21.7077 -12.9821
12 C1y C 19.2364 -16.6247
13 C1x C 20.4428 -18.7329
14 C1a C 24.1790 -12.6307
15 C1a C 21.2977 -11.6410
16 C1z C 18.0943 -17.3215
17 C2x C 19.2246 -19.4297
18 C2y C 18.0884 -18.7212
19 C1x C 16.8121 -16.6187
20 C1a C 18.0826 -15.9219
21 C1x C 16.8121 -19.4238
22 C1x C 15.5999 -17.3215
23 C1y C 15.5999 -18.7212
24 N1c N 14.3816 -19.4238
25 C1a C 13.1695 -18.7212
26 C1a C 14.3759 -20.8235
BOND 30
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 2 7 1
7 3 8 1
8 3 9 1 #Up
9 4 10 1
10 5 11 1
11 6 12 1
12 6 13 1
13 9 14 1 #Up
14 11 15 1
15 12 16 1
16 13 17 1
17 16 18 1
18 16 19 1
19 16 20 1 #Up
20 18 21 1
21 19 22 1
22 21 23 1
23 23 24 1 #Up
24 24 25 1
25 24 26 1
26 7 8 1
27 9 11 1
28 10 12 1
29 17 18 2
30 22 23 1
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