ATOM 29
1 C1x C 18.5500 -20.3000
2 C1x C 18.5500 -21.7000
3 C1x C 19.7400 -22.3300
4 C1y C 20.9300 -21.7000
5 C1z C 20.9300 -20.3000
6 C1x C 19.7400 -19.6000
7 C1x C 22.1200 -22.3300
8 C1x C 23.3100 -21.7000
9 C1y C 23.3100 -20.3000
10 C1y C 22.1200 -19.6000
11 C1y C 24.5000 -19.6000
12 C1z C 24.5000 -18.2700
13 C1x C 23.3100 -17.5700
14 C1x C 22.1200 -18.2700
15 C1x C 26.8800 -19.6000
16 C1x C 26.8800 -18.2700
17 C1y C 25.6900 -17.5700
18 C1c C 25.6900 -16.1700
19 C1b C 26.8800 -15.4700
20 C1a C 24.5000 -15.4700
21 C1b C 28.0700 -16.1700
22 C1c C 29.2600 -15.4700
23 C1c C 30.3800 -16.1700
24 C1a C 31.5700 -15.4700
25 C1b C 29.2600 -14.1400
26 C1a C 30.3800 -17.5700
27 C1a C 24.5000 -16.8700
28 C1a C 20.9300 -18.9000
29 C1a C 30.4724 -13.4400
BOND 32
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 11 15 1
18 15 16 1
19 16 17 1
20 12 17 1
21 17 18 1
22 18 19 1
23 18 20 1 #Down
24 19 21 1
25 21 22 1
26 22 23 1
27 23 24 1
28 22 25 1 #Up
29 23 26 1
30 12 27 1 #Up
31 5 28 1 #Up
32 25 29 1
|