ATOM 42
1 C1x C 10.0800 -16.9400
2 C1y C 10.0800 -18.3400
3 C1x C 11.2924 -19.0400
4 C2y C 12.5049 -18.3400
5 C2y C 12.5049 -16.9400
6 C1z C 11.2924 -16.2400
7 C1a C 12.2824 -15.2501
8 C1a C 10.3025 -15.2501
9 O1a O 8.8676 -19.0400
10 C2b C 13.7424 -16.2400
11 C2b C 14.9549 -16.9400
12 C2c C 16.1673 -16.2400
13 C2b C 17.3797 -16.9400
14 C2b C 18.5922 -16.2400
15 C2b C 19.8046 -16.9400
16 C2c C 21.0170 -16.2400
17 C2b C 22.2295 -16.9400
18 C2b C 23.4419 -16.2400
19 C2b C 24.6544 -16.9400
20 C2b C 25.8668 -16.2400
21 C2c C 27.0792 -16.9400
22 C2b C 28.2917 -16.2400
23 C2b C 29.5041 -16.9400
24 C1a C 13.7360 -19.0510
25 C1a C 16.1673 -14.8400
26 C1a C 21.0170 -14.8401
27 C1a C 27.0792 -18.3400
28 C2b C 30.6907 -16.2545
29 C2c C 31.8740 -16.9374
30 C3b C 33.0670 -16.2480
31 C1a C 31.8743 -18.3398
32 C3b C 34.2795 -15.5480
33 C2y C 35.4919 -14.8480
34 C1z C 36.6994 -15.5452
35 C1x C 37.9119 -14.8452
36 C1y C 37.9118 -13.4452
37 C1x C 36.7043 -12.7480
38 C2y C 35.4919 -13.4480
39 C1a C 34.2746 -12.7452
40 O1a O 39.1475 -12.7315
41 C1a C 37.3994 -16.7576
42 C1a C 35.9994 -16.7576
BOND 43
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 1
7 6 7 1
8 6 8 1
9 2 9 1 #Up
10 5 10 1
11 10 11 2
12 11 12 1
13 12 13 2
14 13 14 1
15 14 15 2
16 15 16 1
17 16 17 2
18 17 18 1
19 18 19 2
20 19 20 1
21 20 21 2
22 21 22 1
23 22 23 2
24 4 24 1
25 12 25 1
26 16 26 1
27 21 27 1
28 23 28 1
29 28 29 2
30 29 30 1
31 29 31 1
32 30 32 3
33 32 33 1
34 33 34 1
35 34 35 1
36 35 36 1
37 36 37 1
38 37 38 1
39 33 38 2
40 38 39 1
41 36 40 1 #Up
42 34 41 1
43 34 42 1
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