ATOM 34
1 C1z C 23.0708 -21.4778
2 C1z C 23.0766 -20.0979
3 C1y C 24.2578 -22.1735
4 O2x O 23.0591 -22.8460
5 C1y C 21.8839 -22.1678
6 C1y C 24.2695 -19.4196
7 C5x C 21.8839 -19.4137
8 C1a C 23.0649 -18.7237
9 C1x C 25.4505 -21.4895
10 C2x C 20.6910 -21.4778
11 O1a O 21.9422 -23.5477
12 C1y C 25.4505 -20.1153
13 C1x C 24.2812 -18.0454
14 C2x C 20.6910 -20.0979
15 O5x O 21.8839 -18.0397
16 C1y C 26.6492 -19.4371
17 C1x C 25.4739 -17.3672
18 C1z C 26.6668 -18.0571
19 C1x C 29.0231 -19.4605
20 C1y C 27.8538 -17.3906
21 C1a C 26.6551 -16.6831
22 C1x C 29.0408 -18.0865
23 C1d C 27.8479 -16.0166
24 C1y C 29.0348 -15.3266
25 C1a C 26.6551 -15.3266
26 O1a O 27.8421 -14.6367
27 C1x C 30.2218 -16.0106
28 O7x O 29.0291 -13.9525
29 C2y C 31.4147 -15.3149
30 C7x C 30.2160 -13.2684
31 C2y C 31.4088 -13.9467
32 C1a C 32.6017 -16.0049
33 O6a O 30.2101 -11.8885
34 C1a C 32.5957 -13.2567
BOND 39
1 1 3 1
2 1 4 1 #Up
3 1 5 1
4 2 6 1
5 2 7 1
6 2 8 1 #Up
7 3 9 1
8 5 10 1
9 5 11 1 #Up
10 6 12 1
11 6 13 1
12 7 14 1
13 7 15 2
14 12 16 1
15 13 17 1
16 16 18 1
17 16 19 1
18 18 20 1
19 18 21 1 #Up
20 19 22 1
21 20 23 1
22 23 24 1
23 23 25 1 #Down
24 23 26 1 #Up
25 24 27 1
26 24 28 1
27 27 29 1
28 28 30 1
29 29 31 2
30 29 32 1
31 30 33 2
32 31 34 1
33 3 4 1 #Up
34 9 12 1
35 10 14 2
36 17 18 1
37 20 22 1
38 30 31 1
39 1 2 1
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