0 mol 62 unq 0 iso 0 dist 7.43801 7.05867 8.52741 15.2515 8.31737 13.2814 numMergedOcc 0
1 mol 62 unq 1 iso 0 dist 7.43801 7.05867 8.52741 13.6032 7.76552 16.1758 numMergedOcc 0
2 mol 85 unq 0 iso 0 dist 8.58689 8.82052 4.34173 12.1012 8.96872 12.9103 numMergedOcc 0
3 mol 111 unq 0 iso 0 dist 9.76075 6.90574 12.0896 8.43135 9.01984 14.1987 numMergedOcc 0
4 mol 120 unq 0 iso 0 dist 5.27549 8.51585 4.80028 5.58087 7.82186 8.40669 numMergedOcc 0
5 mol 120 unq 1 iso 0 dist 5.27549 8.51585 4.80028 5.44428 5.85006 9.67098 numMergedOcc 0
6 mol 154 unq 0 iso 0 dist 5.7306 6.03116 3.44683 10.3386 8.9675 6.31314 numMergedOcc 0
7 mol 158 unq 0 iso 0 dist 8.71292 5.32135 10.0783 6.31999 9.07685 10.8063 numMergedOcc 0
8 mol 163 unq 0 iso 0 dist 5.43385 8.74174 5.57459 11.4143 6.35103 9.29539 numMergedOcc 0
9 mol 167 unq 0 iso 0 dist 7.71402 6.6276 8.73305 10.1351 7.78684 12.9512 numMergedOcc 0
10 mol 173 unq 0 iso 0 dist 8.12102 7.87322 11.8803 5.43254 7.90789 4.0037 numMergedOcc 0
11 mol 173 unq 1 iso 0 dist 7.95138 7.87322 6.94278 5.43254 4.13397 4.0037 numMergedOcc 0
12 mol 260 unq 0 iso 0 dist 6.57555 8.2776 4.933 6.39739 8.99274 8.54084 numMergedOcc 0
13 mol 260 unq 1 iso 0 dist 6.57555 8.2776 4.933 4.9453 8.62247 12.1744 numMergedOcc 0
14 mol 261 unq 0 iso 0 dist 9.00616 5.67349 9.46424 14.4695 7.01147 12.0814 numMergedOcc 0
15 mol 261 unq 1 iso 0 dist 9.00616 5.67349 9.46424 16.6016 8.69549 16.9506 numMergedOcc 0
16 mol 261 unq 2 iso 0 dist 6.35699 5.67349 7.48263 14.4695 9.53489 12.0814 numMergedOcc 0
17 mol 266 unq 0 iso 0 dist 5.15737 8.39358 7.24378 10.5649 9.27812 16.4143 numMergedOcc 0
