0 mol 18 unq 0 iso 0 dist 7.63261 7.23594 6.47139 6.05493 6.09533 9.1397 numMergedOcc 0
1 mol 46 unq 0 iso 0 dist 8.99557 8.2513 17.0196 4.38299 10.887 9.45756 numMergedOcc 0
2 mol 52 unq 0 iso 0 dist 9.89949 7.68916 10.8037 4.49773 13.1812 6.22221 numMergedOcc 0
3 mol 78 unq 0 iso 0 dist 7.50417 7.80757 4.4651 13.7086 8.03895 7.91148 numMergedOcc 0
4 mol 78 unq 1 iso 0 dist 7.50417 7.80757 4.4651 10.9209 5.68873 6.59794 numMergedOcc 0
5 mol 78 unq 2 iso 0 dist 7.50417 7.80757 4.4651 15.7494 9.84838 8.34957 numMergedOcc 0
6 mol 78 unq 3 iso 0 dist 8.29369 9.2835 7.17843 12.7015 8.48827 7.91148 numMergedOcc 0
7 mol 78 unq 4 iso 0 dist 8.29369 9.2835 7.17843 12.9102 7.14048 6.59794 numMergedOcc 0
8 mol 78 unq 5 iso 0 dist 8.29369 9.2835 7.17843 10.2933 9.53722 8.34957 numMergedOcc 0
9 mol 78 unq 6 iso 0 dist 6.75455 5.02591 7.17843 11.1086 8.48827 7.91148 numMergedOcc 0
10 mol 78 unq 7 iso 0 dist 6.75455 5.02591 7.17843 10.2834 7.14048 6.59794 numMergedOcc 0
11 mol 78 unq 8 iso 0 dist 6.75455 5.02591 7.17843 10.0935 9.53722 8.34957 numMergedOcc 0
12 mol 78 unq 9 iso 0 dist 6.28063 5.02591 4.4651 11.1086 8.03895 7.91148 numMergedOcc 0
13 mol 78 unq 10 iso 0 dist 6.28063 5.02591 4.4651 10.2834 5.68873 6.59794 numMergedOcc 0
14 mol 78 unq 11 iso 0 dist 6.28063 5.02591 4.4651 10.0935 9.84838 8.34957 numMergedOcc 0
15 mol 114 unq 0 iso 0 dist 6.34761 5.87387 5.74067 10.4408 13.9615 9.93438 numMergedOcc 0
16 mol 122 unq 0 iso 0 dist 4.38961 5.09114 4.42285 4.92712 6.80798 4.42563 numMergedOcc 0
17 mol 123 unq 0 iso 0 dist 8.64091 8.87148 4.07494 8.75597 10.5522 8.111 numMergedOcc 0
18 mol 136 unq 0 iso 0 dist 6.27434 6.53519 6.38418 4.3516 9.73897 9.92504 numMergedOcc 0
19 mol 136 unq 1 iso 0 dist 6.27434 6.53519 6.38418 4.25637 10.4586 9.96485 numMergedOcc 0
20 mol 204 unq 0 iso 0 dist 6.99474 6.32652 4.30341 5.43925 9.68316 7.16758 numMergedOcc 0
21 mol 218 unq 0 iso 0 dist 8.59762 5.52981 4.94196 8.95992 7.68062 6.1896 numMergedOcc 0
22 mol 218 unq 1 iso 0 dist 8.59762 5.52981 4.94196 6.50485 10.7563 6.09255 numMergedOcc 0
23 mol 218 unq 2 iso 0 dist 9.42881 5.52981 11.7195 8.95992 17.0652 6.1896 numMergedOcc 0
24 mol 218 unq 3 iso 0 dist 9.42881 5.52981 11.7195 6.50485 11.929 6.09255 numMergedOcc 0
25 mol 265 unq 0 iso 0 dist 8.50624 5.81421 7.602 3.55274 11.0436 9.28128 numMergedOcc 0
26 mol 283 unq 0 iso 0 dist 5.33054 7.92491 4.44211 5.91899 9.35302 9.07995 numMergedOcc 0
27 mol 292 unq 0 iso 0 dist 9.22345 5.69465 8.04474 7.17049 11.1568 6.69619 numMergedOcc 0
28 mol 292 unq 1 iso 0 dist 9.22345 5.69465 8.04474 7.97171 10.2196 4.49592 numMergedOcc 0
