ATOM 24
1 O7a O 28.5398 -18.8159
2 C7a C 29.9607 -19.5987
3 C8y C 29.9551 -20.9900
4 O6a O 31.1676 -18.9115
5 C8x C 28.7443 -21.6741
6 C8y C 28.7457 -23.0654
7 C8y C 29.9468 -23.7626
8 C8y C 31.1537 -23.0754
9 C8x C 31.1595 -21.6840
10 O1a O 23.7261 -18.7985
11 C1z C 26.1377 -16.0260
12 C1x C 24.9306 -16.7132
13 C1y C 24.9264 -18.1072
14 C1y C 26.1256 -18.8076
15 C1y C 27.3395 -18.1133
16 C1x C 27.3473 -16.7256
17 C6a C 26.1440 -14.6347
18 O1a O 26.1209 -20.1989
19 O1a O 24.9042 -15.4273
20 O1a O 27.5319 -23.7526
21 O1a O 29.9412 -25.1539
22 O1a O 32.3548 -23.7724
23 O6a O 24.9361 -13.9301
24 O6a O 27.3581 -13.9409
BOND 25
1 9 3 1
2 14 18 1 #Down
3 13 10 1 #Down
4 2 3 1
5 11 19 1 #Down
6 1 2 1
7 2 4 2
8 6 20 1
9 7 21 1
10 3 5 2
11 8 22 1
12 5 6 1
13 6 7 2
14 7 8 1
15 11 12 1
16 12 13 1
17 13 14 1
18 14 15 1
19 15 16 1
20 16 11 1
21 15 1 1 #Up
22 8 9 2
23 17 23 2
24 11 17 1 #Up
25 17 24 1
|