ATOM 30
1 C1y C 25.6816 -15.9593
2 N4y N 27.0216 -15.5321
3 O2x O 24.5405 -15.0990
4 C1y C 25.2602 -17.2586
5 C8y C 28.0399 -16.4918
6 C8x C 27.3376 -14.1804
7 C1y C 23.3993 -15.9359
8 C1y C 23.8440 -17.2586
9 O1a O 25.6933 -18.6163
10 N5x N 29.3801 -16.0881
11 O5x O 27.7239 -17.8612
12 C8x C 28.6778 -13.7707
13 C1b C 22.0651 -15.5087
14 O1a O 23.4051 -18.6280
15 C8y C 29.6903 -14.7304
16 O2b O 20.9414 -16.3515
17 N1a N 31.0421 -14.3324
18 P1b P 19.5544 -16.3515
19 O2c O 18.1619 -16.3515
20 O1c O 19.5486 -17.7443
21 O1c O 19.5486 -14.9644
22 P1b P 16.7808 -16.3515
23 C1b C 15.3880 -16.3515
24 O1c O 16.7691 -17.7443
25 O1c O 16.7691 -14.9644
26 C1b C 14.6857 -15.1401
27 N1d N 13.2869 -15.1401 #+
28 C1a C 13.2869 -16.5401
29 C1a C 13.2869 -13.7401
30 C1a C 11.8869 -15.1401
BOND 31
1 1 2 1 #Up
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 4 8 1
8 4 9 1 #Down
9 5 10 1
10 5 11 2
11 6 12 2
12 7 13 1 #Up
13 8 14 1 #Down
14 10 15 2
15 13 16 1
16 15 17 1
17 16 18 1
18 18 19 1
19 18 20 1
20 18 21 2
21 19 22 1
22 22 23 1
23 22 24 1
24 22 25 2
25 23 26 1
26 26 27 1
27 7 8 1
28 12 15 1
29 27 28 1
30 27 29 1
31 27 30 1
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