ATOM 31
1 C1z C 24.7935 -17.0633
2 C1z C 23.5801 -17.7574
3 C1y C 24.7992 -15.6574
4 C1y C 26.0067 -17.7631
5 C1b C 24.9218 -18.4574
6 C1x C 22.8801 -18.9706
7 O2x O 24.2860 -18.9706
8 C1x C 22.3785 -17.0633
9 C1z C 26.0184 -14.9574
10 C1x C 23.5860 -14.9517
11 C1x C 27.2259 -17.0690
12 O7a O 26.6310 -19.0990
13 O7a O 25.4818 -19.6589
14 C1x C 22.3785 -15.6574
15 C1y C 26.0243 -13.5574
16 C1y C 27.2316 -15.6691
17 C1a C 27.2259 -14.0417
18 C7a C 27.8325 -19.7873
19 C7a C 24.7876 -20.8664
20 C1x C 27.1325 -12.7000
21 O2x O 24.8634 -12.7759
22 C1a C 28.5208 -15.3891
23 C1a C 27.8325 -21.1814
24 O6a O 29.0342 -19.0873
25 O6a O 23.3935 -20.8664
26 C1a C 25.4876 -22.0681
27 C1y C 26.6543 -11.4400
28 C1y C 25.2543 -11.4226
29 C2x C 27.0393 -10.0226
30 O2x O 24.7642 -10.1101
31 C2x C 25.8666 -9.2365
BOND 35
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Down
5 2 6 1 #Up
6 2 7 1 #Down
7 2 8 1
8 3 9 1
9 3 10 1
10 4 11 1
11 4 12 1 #Down
12 5 13 1
13 8 14 1
14 9 15 1
15 9 16 1
16 9 17 1 #Down
17 12 18 1
18 13 19 1
19 15 20 1
20 15 21 1
21 16 22 1 #Down
22 18 23 1
23 18 24 2
24 19 25 2
25 19 26 1
26 20 27 1
27 21 28 1
28 27 29 1
29 28 30 1
30 29 31 2
31 6 7 1
32 10 14 1
33 11 16 1
34 27 28 1
35 30 31 1
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