ATOM 29
1 C1z C 23.0453 -18.4807
2 C1y C 23.0396 -19.8876
3 C1y C 24.2655 -17.7861
4 C1x C 21.8312 -17.7861
5 C1a C 23.0338 -17.0796
6 C1z C 21.8312 -20.5881
7 C1x C 24.2538 -20.5940
8 C1y C 25.4681 -18.4924
9 C1x C 24.2771 -16.3908
10 C1x C 20.6170 -18.4807
11 C1y C 20.6170 -19.8876
12 C1a C 21.1189 -22.0125
13 C1a C 22.3331 -22.0825
14 C1y C 25.4622 -19.8935
15 C1y C 26.6882 -17.8095
16 C1x C 25.4915 -15.6962
17 O1a O 19.3969 -20.5824
18 O1a O 26.6706 -20.5881
19 C2y C 26.6999 -16.4084
20 C1a C 27.8967 -18.5041
21 C2b C 27.9200 -15.7136
22 C7a C 27.9258 -14.3184
23 O7a O 29.1402 -13.6236
24 O6a O 26.7057 -13.6236
25 C1b C 30.3543 -14.3125
26 C1b C 31.5569 -13.6120
27 N1c N 32.7712 -14.3067
28 C1a C 33.9854 -13.6062
29 C1a C 32.7712 -15.7019
BOND 31
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
9 4 10 1
10 6 11 1
11 6 12 1
12 6 13 1
13 7 14 1
14 8 15 1
15 9 16 1
16 11 17 1 #Up
17 14 18 1 #Up
18 15 19 1
19 15 20 1 #Down
20 19 21 2
21 21 22 1
22 22 23 1
23 22 24 2
24 23 25 1
25 25 26 1
26 26 27 1
27 27 28 1
28 27 29 1
29 8 14 1
30 10 11 1
31 16 19 1
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