ATOM 26
1 C1y C 9.0300 -7.2100
2 C1y C 9.0300 -5.8800
3 C1y C 7.8400 -7.9100
4 C2y C 10.2900 -7.6300
5 C2y C 7.8400 -5.1800
6 C1x C 10.2900 -5.4600
7 O2a O 7.8400 -10.0100
8 O2x O 6.6500 -7.2100
9 C1y C 11.1300 -6.5100
10 C2a C 10.7800 -8.9600
11 C2x C 6.6500 -5.8800
12 C6a C 7.8400 -3.8500
13 C1y C 9.3100 -11.0600
14 O1a O 12.4600 -6.5100
15 O6a O 6.6500 -3.1500
16 O6a O 9.0300 -3.1500
17 O2x O 10.5000 -10.4300
18 C1y C 9.3100 -12.4600
19 C1y C 11.6900 -11.0600
20 C1y C 10.5000 -13.1600
21 O1a O 8.1900 -13.1600
22 C1y C 11.6900 -12.4600
23 C1b C 12.8800 -10.4300
24 O1a O 10.5000 -14.4900
25 O1a O 12.8800 -13.1600
26 O1a O 13.9300 -11.2700
BOND 28
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1 #Down
7 3 8 1
8 4 9 1
9 4 10 2
10 5 11 2
11 5 12 1
12 13 7 1 #Down
13 9 14 1 #Down
14 12 15 1
15 12 16 2
16 13 17 1
17 13 18 1
18 17 19 1
19 18 20 1
20 18 21 1 #Up
21 19 22 1
22 19 23 1 #Down
23 20 24 1 #Down
24 22 25 1 #Up
25 23 26 1
26 6 9 1
27 8 11 1
28 20 22 1
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