ATOM 40
1 C1z C 29.2843 -19.4217
2 C1y C 28.0988 -18.7151
3 C1z C 30.4815 -18.7559
4 C1y C 29.2668 -20.7999
5 O2x O 30.4698 -20.1108
6 C1z C 26.8958 -19.3866
7 C1y C 28.0521 -17.3369
8 C1z C 30.4406 -17.3836
9 C1x C 32.8584 -18.7269
10 O1a O 31.4626 -19.7253
11 C1x C 28.0579 -21.4716
12 C1y C 26.8782 -20.7648
13 C1x C 25.7103 -18.6858
14 C1a C 26.8841 -17.9967
15 C5x C 29.3310 -16.6711
16 O1a O 26.9424 -16.6244
17 C1y C 31.7078 -16.7179
18 C1a C 30.4991 -15.9937
19 C1x C 32.8175 -17.4303
20 C1x C 25.6869 -21.4423
21 C1y C 24.5131 -19.3632
22 O5x O 29.3601 -15.2929
23 C2y C 31.7371 -15.3396
24 C1y C 24.5014 -20.7415
25 O2x O 23.3100 -18.6684
26 C2x C 33.1094 -15.3396
27 C1x C 31.3108 -14.0315
28 O2x O 23.2983 -21.4306
29 C1z C 22.1128 -19.3515
30 C7x C 33.5416 -14.0315
31 O7x O 32.4203 -13.2196
32 C1y C 22.1070 -20.7357
33 C1y C 20.9215 -18.6624
34 O1a O 22.1011 -17.9733
35 O6a O 34.8557 -13.6051
36 O2x O 20.9215 -21.4306
37 C1x C 19.7127 -19.3515
38 O1a O 20.9098 -17.2784
39 C1y C 19.7127 -20.7357
40 C1a C 18.5212 -21.4306
BOND 47
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 3 8 1
8 3 9 1
9 3 10 1 #Up
10 4 11 1
11 6 12 1
12 6 13 1
13 6 14 1 #Up
14 7 15 1
15 7 16 1 #Down
16 8 17 1
17 8 18 1 #Up
18 9 19 1
19 12 20 1
20 13 21 1
21 15 22 2
22 17 23 1
23 20 24 1
24 21 25 1
25 23 26 2
26 23 27 1
27 24 28 1
28 25 29 1
29 26 30 1
30 27 31 1
31 28 32 1
32 29 33 1
33 29 34 1 #Up
34 30 35 2
35 32 36 1
36 33 37 1
37 33 38 1 #Up
38 36 39 1
39 39 40 1 #Down
40 4 5 1 #Up
41 8 15 1
42 11 12 1
43 17 19 1
44 21 24 1
45 29 32 1
46 30 31 1
47 37 39 1
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