ATOM 33
1 C2x C 21.2370 -17.0164
2 C7x C 21.2370 -18.4298
3 C1y C 23.6850 -18.4298
4 C1z C 23.6850 -17.0164
5 C2x C 22.4610 -16.3097
6 C1x C 24.9090 -19.1364
7 C5x C 26.1330 -18.4298
8 C1z C 26.1330 -17.0164
9 C1y C 24.9090 -16.3097
10 C1z C 27.3570 -16.3097
11 C1z C 27.3570 -14.8963
12 C1x C 26.1330 -14.1896
13 C1x C 24.9090 -14.8963
14 C1y C 28.5810 -17.0164
15 C7x C 29.8050 -16.3097
16 O7x O 29.8050 -14.8963
17 C1y C 28.5810 -14.1896
18 C8y C 28.5810 -12.7763
19 C8x C 29.7280 -11.9429
20 O2x O 29.2899 -10.5945
21 C8x C 27.8721 -10.5945
22 C8x C 27.4339 -11.9429
23 O6a O 31.0161 -17.0090
24 O2x O 27.3570 -17.7230
25 C1a C 26.7630 -15.5330
26 C1a C 23.6850 -15.6030
27 O5x O 27.3570 -19.1364
28 C1z C 23.1903 -18.9244
29 O7x O 22.0561 -19.2669
30 C1a C 23.8788 -20.6208
31 C1a C 22.5660 -20.6185
32 O6a O 19.8733 -18.8017
33 C1a C 27.3570 -13.4830
BOND 38
1 1 2 1
2 3 4 1
3 4 5 1
4 1 5 2
5 3 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 4 9 1
10 8 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 9 13 1
15 10 14 1
16 14 15 1
17 15 16 1
18 16 17 1
19 11 17 1
20 17 18 1 #Down
21 18 19 2
22 19 20 1
23 20 21 1
24 21 22 2
25 18 22 1
26 15 23 2
27 10 24 1 #Up
28 14 24 1 #Up
29 8 25 1 #Up
30 4 26 1 #Up
31 7 27 2
32 3 28 1
33 28 29 1
34 28 30 1
35 28 31 1
36 2 29 1
37 2 32 2
38 11 33 1 #Down
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