ATOM 12
1 C1z C 18.8294 -16.2613
2 C1z C 19.4454 -15.1460
3 C5x C 17.6678 -16.8773
4 C1y C 20.1790 -16.4964
5 C1y C 19.4454 -17.3003
6 C1x C 18.2837 -18.1513
7 C1x C 20.8359 -17.6875
8 C1a C 17.9404 -15.3568
9 C1a C 20.3346 -14.2568
10 C1a C 18.5562 -14.2568
11 O5x O 16.4847 -16.4900
12 O1a O 20.9745 -15.3813
BOND 13
1 1 3 1
2 1 4 1
3 3 6 1
4 4 7 1
5 5 6 1
6 5 7 1
7 1 8 1
8 2 9 1
9 2 10 1
10 3 11 2
11 1 2 1 #Up
12 5 2 1
13 4 12 1
|