ATOM 42
1 C8y C 10.4300 -19.6700
2 N1b N 11.6200 -20.3700
3 C8x C 9.1700 -20.3700
4 C8x C 10.4300 -18.2700
5 C2c C 12.8100 -19.6700
6 C8x C 7.9800 -19.6700
7 C8x C 9.1700 -17.5700
8 N1b N 14.0700 -20.3700
9 N2a N 12.8100 -18.2700
10 C8y C 7.9800 -18.2700
11 C2c C 15.2600 -19.6700
12 X Cl 6.7900 -17.5700
13 N1b N 16.4500 -20.3700
14 N2a N 15.2600 -18.2700
15 C1b C 17.7100 -19.6700
16 C1b C 18.9000 -20.3700
17 C1b C 20.0900 -19.6700
18 C1b C 21.3500 -20.3700
19 C1b C 22.5400 -19.6700
20 C1b C 23.7300 -20.3700
21 N1b N 24.9900 -19.6700
22 C2c C 26.1800 -20.3700
23 N1b N 27.3700 -19.6700
24 N2a N 26.1800 -21.7700
25 C2c C 28.6300 -20.3700
26 N1b N 29.8200 -19.6700
27 N2a N 28.6300 -21.7700
28 C8y C 31.0100 -20.3700
29 C8x C 31.0100 -21.7700
30 C8x C 32.2700 -19.6700
31 C8x C 32.2700 -22.4700
32 C8x C 33.4600 -20.3700
33 C8y C 33.4600 -21.7700
34 X Cl 34.6500 -22.4700
35 C6a C 39.9000 -21.0700
36 C1a C 41.0900 -21.7700
37 O6a O 38.7100 -21.7700
38 O6a O 39.9000 -19.6700
39 C6a C 39.9000 -21.0700
40 C1a C 41.0900 -21.7700
41 O6a O 38.7100 -21.7700
42 O6a O 39.9000 -19.6700
BOND 41
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 3 6 1
6 4 7 2
7 5 8 1
8 5 9 2
9 6 10 2
10 8 11 1
11 10 12 1
12 11 13 1
13 11 14 2
14 13 15 1
15 15 16 1
16 16 17 1
17 17 18 1
18 18 19 1
19 19 20 1
20 20 21 1
21 21 22 1
22 22 23 1
23 22 24 2
24 23 25 1
25 25 26 1
26 25 27 2
27 26 28 1
28 28 29 2
29 28 30 1
30 29 31 1
31 30 32 2
32 31 33 2
33 33 34 1
34 7 10 1
35 32 33 1
36 35 36 1
37 35 37 1
38 35 38 2
39 39 40 1
40 39 41 1
41 39 42 2
BRACKET 1 37.0300 -22.6800 37.0300 -18.7600
1 43.0500 -18.7600 43.0500 -22.6800
1 2
ORIGINAL 1 35 36 37 38
REPEAT 1 39 40 41 42
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