ATOM 37
1 C1z C 27.8065 -15.7429
2 C1z C 26.6011 -16.4391
3 C1z C 27.8125 -14.3384
4 C1y C 29.0061 -16.4451
5 O2x O 27.7948 -17.1297
6 C1z C 26.3143 -17.9485
7 C1y C 25.3957 -15.7429
8 C1a C 27.2194 -14.9706
9 C1y C 29.0296 -13.6419
10 C1x C 26.6011 -13.6362
11 C1a C 27.8007 -12.9397
12 C7x C 30.2292 -15.7546
13 C1z C 24.9216 -17.9548
14 O2x O 26.8820 -19.0841
15 O1a O 27.7536 -18.0313
16 C1z C 24.3541 -16.6733
17 C1x C 25.3898 -14.3384
18 C8y C 29.0233 -12.2457
19 O7x O 30.2351 -14.3501
20 O6a O 31.4348 -16.4451
21 C5x C 24.6349 -19.3183
22 O1a O 23.4996 -17.9490
23 C1z C 25.8463 -20.0206
24 C2b C 22.6527 -16.1169
25 C1a C 24.3424 -15.2806
26 C8x C 27.9050 -11.4090
27 C8x C 30.1576 -11.4422
28 O5x O 23.3359 -19.9092
29 C1a C 26.5485 -21.2377
30 C1a C 25.1264 -21.2377
31 C2b C 21.4414 -16.8191
32 C8x C 28.3423 -10.0905
33 O2x O 29.7479 -10.1093
34 C7a C 21.4355 -18.2236
35 O7a O 20.2184 -18.9081
36 O6a O 22.6410 -18.9199
37 C1a C 19.0011 -18.2176
BOND 42
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 2 7 1
7 2 8 1 #Up
8 3 9 1
9 3 10 1
10 3 11 1 #Down
11 4 12 1
12 6 13 1
13 6 14 1
14 6 15 1 #Up
15 7 16 1
16 7 17 1
17 9 18 1 #Down
18 9 19 1
19 12 20 2
20 13 21 1
21 13 22 1 #Up
22 14 23 1
23 16 24 1
24 16 25 1 #Up
25 18 26 1
26 18 27 2
27 21 28 2
28 23 29 1
29 23 30 1
30 24 31 2
31 26 32 2
32 27 33 1
33 31 34 1
34 34 35 1
35 34 36 2
36 35 37 1
37 4 5 1 #Up
38 10 17 1
39 12 19 1
40 13 16 1
41 21 23 1
42 32 33 1
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