ATOM 22
1 C1y C 25.8682 -16.2106
2 C1y C 24.5456 -16.5666
3 C1y C 26.5849 -15.0341
4 C2y C 26.6197 -17.3652
5 C1y C 22.7914 -15.9958
6 O7x O 24.5456 -17.9359
7 O7a O 27.9073 -15.3948
8 C1x C 26.5906 -13.6590
9 C7x C 25.7572 -18.4249
10 C2a C 27.9948 -17.3652
11 C1z C 21.8249 -15.0224
12 C7a C 29.0898 -14.7073
13 C2y C 25.3967 -12.9600
14 O6a O 26.1191 -19.7532
15 C1x C 21.8249 -13.6474
16 C1a C 30.2791 -15.3889
17 O6a O 29.1540 -13.3264
18 C2x C 24.2014 -13.6474
19 C1a C 25.4026 -11.5849
20 C1x C 23.0191 -12.9541
21 O2x O 21.3133 -16.3254
22 C1a C 20.5435 -14.4403
BOND 24
1 1 3 1
2 1 4 1
3 2 5 1
4 2 6 1
5 3 7 1 #Up
6 3 8 1
7 4 9 1
8 4 10 2
9 5 11 1
10 7 12 1
11 8 13 1
12 9 14 2
13 11 15 1
14 11 21 1
15 12 16 1
16 12 17 2
17 13 18 2
18 13 19 1
19 15 20 1
20 6 9 1
21 18 20 1
22 5 21 1
23 1 2 1
24 11 22 1 #Up
|