ATOM 30
1 C1z C 26.2054 -15.7377
2 C1y C 26.2112 -17.1286
3 C2y C 25.0068 -15.0364
4 O2x O 27.4096 -16.4214
5 C1y C 27.4096 -15.0538
6 C1y C 25.0068 -17.8067
7 C1z C 23.8096 -15.7260
8 C2x C 25.0185 -13.6512
9 O7x O 27.4212 -13.6688
10 C1d C 28.7421 -14.6921
11 C1y C 23.8156 -17.1169
12 C1x C 22.6053 -15.0305
13 C1a C 23.7980 -14.3349
14 C7x C 26.2228 -12.9673
15 C1b C 29.7164 -13.3711
16 C1a C 29.9453 -15.3876
17 O1a O 30.0865 -14.3232
18 C1z C 22.6053 -17.8067
19 C1y C 21.4010 -15.7260
20 O6a O 26.2345 -11.5823
21 S4a S 29.7760 -12.0326
22 C1y C 21.4010 -17.1169
23 C1a C 21.3893 -18.4962
24 O2x O 20.1909 -16.4273
25 C1a C 29.7804 -10.5484
26 O3c O 31.1669 -12.0326
27 O3c O 28.3910 -12.0326
28 O7x O 24.6388 -19.1606
29 C7x C 22.9610 -19.1606
30 O6a O 22.1028 -20.2812
BOND 35
1 1 4 1 #Down
2 1 5 1
3 2 6 1
4 3 7 1
5 3 8 2
6 5 9 1
7 5 10 1
8 6 11 1
9 7 12 1
10 7 13 1 #Up
11 8 14 1
12 10 15 1
13 10 16 1 #Up
14 10 17 1 #Down
15 11 18 1
16 12 19 1
17 14 20 2
18 15 21 1
19 18 22 1
20 18 23 1 #Down
21 19 24 1
22 21 25 1
23 21 26 2
24 21 27 2
25 2 4 1 #Down
26 7 11 1
27 9 14 1
28 19 22 1
29 22 24 1
30 6 28 1
31 1 2 1
32 18 29 1
33 29 28 1
34 1 3 1
35 29 30 2
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