ATOM 31
1 N5y N 32.0953 -23.0108 #+
2 C8y C 32.7359 -21.7704
3 C8y C 33.0794 -24.0010
4 C1b C 30.8838 -22.3178
5 S2x S 34.1103 -21.9974
6 C1c C 32.1068 -20.5240
7 C8y C 34.3200 -23.3719
8 C1a C 32.9220 -25.3812
9 C8y C 29.6782 -23.0168
10 C1c C 30.7209 -20.4426
11 O1a O 32.8756 -19.3593
12 C1b C 35.5605 -24.0126
13 C8y C 29.6782 -24.4202
14 C8x C 28.4552 -22.3236
15 C1b C 36.7311 -23.2555
16 N5x N 28.4552 -25.1367
17 N1a N 30.8838 -25.1191
18 N5x N 27.2555 -23.0168
19 O2b O 37.9716 -23.8961
20 C8y C 27.2555 -24.4202
21 P1b P 39.1423 -23.1390
22 C1a C 26.0499 -25.1191
23 O2c O 40.3826 -23.7796
24 O1c O 39.5674 -24.5366
25 P1b P 41.5534 -23.0224
26 O1c O 42.7880 -23.6574
27 O1c O 41.9786 -24.4201
28 O1c O 39.1423 -21.7433
29 O1c O 41.5534 -21.6268
30 C1a C 30.0919 -19.1887
31 C1a C 29.9549 -21.6059
BOND 32
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 6 10 1
10 6 11 1
11 7 12 1
12 9 13 2
13 9 14 1
14 12 15 1
15 13 16 1
16 13 17 1
17 14 18 2
18 15 19 1
19 16 20 2
20 19 21 1
21 20 22 1
22 21 23 1
23 21 24 1
24 23 25 1
25 25 26 1
26 25 27 1
27 5 7 1
28 18 20 1
29 21 28 2
30 25 29 2
31 10 30 1
32 10 31 1
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