ATOM 27
1 O7a O 25.9422 -15.2874
2 C7a C 27.4225 -14.5244
3 C2c C 28.6201 -15.2169
4 O6a O 27.4225 -13.1392
5 C1z C 23.1001 -12.6099
6 C1y C 21.8578 -13.2239
7 C1x C 24.3516 -13.1899
8 C1x C 23.1028 -11.2317
9 O2x O 24.3050 -11.9184
10 C1z C 21.5557 -14.7073
11 C1y C 20.6614 -12.5273
12 C1y C 24.6737 -14.5434
13 C1y C 22.4280 -15.6531
14 C2y C 20.1774 -14.7138
15 O1a O 20.5668 -16.0437
16 C2x C 19.6183 -13.4472
17 O1a O 20.5228 -11.1467
18 C1y C 23.8198 -15.7139
19 O7x O 22.0106 -16.9853
20 C1a C 19.4886 -15.9151
21 C2y C 24.2650 -16.9655
22 C7x C 23.1439 -17.7877
23 C2a C 25.5911 -17.3747
24 O6a O 23.1563 -19.1746
25 C1a C 29.8324 -14.5181
26 C2b C 28.6192 -16.6161
27 C1a C 27.4069 -17.3149
BOND 30
1 5 7 1
2 5 8 1 #Up
3 5 9 1 #Down
4 6 10 1
5 6 11 1
6 7 12 1
7 10 13 1
8 10 14 1
9 10 15 1 #Down
10 11 16 1
11 11 17 1 #Up
12 12 18 1
13 13 19 1
14 14 20 1
15 18 21 1
16 19 22 1
17 21 23 2
18 22 24 2
19 8 9 1
20 13 18 1
21 14 16 2
22 21 22 1
23 12 1 1 #Up
24 2 4 2
25 2 3 1
26 3 25 1
27 1 2 1
28 3 26 2
29 5 6 1
30 26 27 1
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