ATOM 37
1 C1y C 23.4047 -16.1354
2 C1y C 22.0702 -16.4908
3 C1y C 24.1273 -14.9466
4 C2y C 24.1621 -17.2950
5 C2x C 20.3046 -15.9139
6 O7x O 22.0702 -17.8719
7 O7a O 25.4616 -15.3138
8 C1x C 24.1330 -13.5597
9 C7x C 23.2938 -18.3672
10 C2a C 25.5489 -17.3650
11 C2y C 19.3257 -14.9350
12 C7a C 26.6561 -14.6203
13 C2y C 22.9268 -12.8547
14 O6a O 23.6551 -19.7075
15 C1y C 19.3257 -13.5481
16 C1a C 18.0436 -15.4595
17 C2c C 27.8507 -15.3079
18 O6a O 26.6504 -13.2277
19 C2x C 21.7265 -13.5481
20 C1a C 22.9327 -11.4679
21 C1x C 20.5319 -12.8488
22 O7a O 18.1252 -12.8488
23 C7a C 16.9249 -13.5307
24 C1a C 15.7361 -12.8372
25 O6a O 16.9190 -14.9176
26 C1b C 29.0571 -14.6093
27 C2b C 27.8526 -16.7020
28 C1b C 29.0608 -17.3976
29 O7a O 30.2653 -15.3049
30 C7a C 31.4719 -14.6061
31 C2c C 32.6802 -15.3017
32 C1b C 33.8865 -14.6031
33 C2b C 32.6820 -16.6958
34 C1a C 33.8903 -17.3913
35 O6a O 31.4700 -13.2120
36 O1a O 35.0948 -15.2984
37 O1a O 30.2672 -16.6990
BOND 38
1 8 13 1
2 9 14 2
3 11 15 1
4 11 16 1
5 12 17 1
6 12 18 2
7 13 19 2
8 13 20 1
9 15 21 1
10 15 22 1 #Up
11 22 23 1
12 23 24 1
13 23 25 2
14 6 9 1
15 19 21 1
16 17 26 1
17 1 2 1
18 17 27 2
19 1 3 1
20 27 28 1
21 1 4 1
22 26 29 1
23 2 5 1
24 29 30 1
25 2 6 1
26 30 31 1
27 3 7 1 #Up
28 31 32 1
29 3 8 1
30 31 33 2
31 4 9 1
32 33 34 1
33 4 10 2
34 30 35 2
35 5 11 2
36 32 36 1
37 7 12 1
38 28 37 1
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