ATOM 32
1 C8y C 24.3089 -17.0349
2 C8y C 24.3205 -15.6345
3 C5x C 25.5167 -17.7410
4 C8y C 23.0951 -17.7293
5 C1x C 25.5399 -14.9401
6 C8y C 23.1068 -14.9227
7 C1z C 26.7303 -17.0524
8 O5x O 25.5750 -19.1414
9 C8y C 21.8873 -17.0233
10 O1a O 23.0835 -19.1179
11 C1y C 26.7477 -15.6519
12 C8y C 21.8932 -15.6229
13 C5x C 27.9264 -17.7643
14 O1a O 26.7127 -18.4469
15 C8y C 20.6795 -17.7235
16 C1y C 27.9614 -14.9694
17 C8y C 20.6795 -14.9168
18 C2y C 29.2159 -17.0874
19 O5x O 27.9032 -19.1705
20 C8x C 19.4599 -17.0233
21 O1a O 20.6795 -19.1238
22 C2y C 29.1634 -15.6870
23 N1c N 27.9555 -13.5690
24 C8x C 19.4599 -15.6229
25 C5a C 30.3539 -17.8051
26 O1a O 30.3947 -15.0044
27 N1a N 31.5792 -17.1224
28 O5a O 30.4005 -19.2055
29 C1a C 26.7387 -12.8733
30 C1a C 29.1495 -12.8731
31 X Cl 20.6811 -13.5103
32 C1a C 23.1120 -13.5101
BOND 35
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 2
8 4 9 2
9 4 10 1
10 5 11 1
11 6 12 2
12 7 13 1
13 7 14 1 #Down
14 9 15 1
15 11 16 1
16 12 17 1
17 13 18 1
18 13 19 2
19 15 20 2
20 15 21 1
21 16 22 1
22 16 23 1 #Down
23 17 24 2
24 18 25 1
25 22 26 1
26 25 27 1
27 25 28 2
28 7 11 1
29 9 12 1
30 18 22 2
31 20 24 1
32 23 29 1
33 23 30 1
34 17 31 1
35 6 32 1
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