0 mol 54 unq 0 iso 0 dist 6.10175 5.01159 5.7405 8.41365 10.352 6.30987 numMergedOcc 0
1 mol 61 unq 0 iso 0 dist 9.94756 14.4038 9.32664 19.0919 11.6535 9.52519 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 4.85152 5.47738 7.2131 6.58062 5.02124 7.1539 numMergedOcc 0
3 mol 92 unq 1 iso 0 dist 4.85152 4.665 7.44343 7.36397 6.12826 6.72712 numMergedOcc 0
4 mol 92 unq 2 iso 0 dist 4.85152 4.665 7.44343 6.58062 5.02124 5.39745 numMergedOcc 0
5 mol 135 unq 0 iso 0 dist 7.54797 10.6553 9.03598 10.9224 4.90013 7.12936 numMergedOcc 0
6 mol 141 unq 0 iso 0 dist 8.51265 13.1683 7.35385 18.4706 10.3678 7.31037 numMergedOcc 0
7 mol 141 unq 1 iso 0 dist 9.98097 10.537 9.80549 15.0435 8.51234 8.00449 numMergedOcc 0
8 mol 156 unq 0 iso 0 dist 6.67598 5.02458 9.6281 9.40225 10.3893 5.81122 numMergedOcc 0
9 mol 156 unq 1 iso 0 dist 8.34508 17.0458 9.6281 16.1608 10.3893 5.81122 numMergedOcc 0
10 mol 156 unq 2 iso 0 dist 8.79185 5.02458 6.22667 9.40225 7.02779 5.81122 numMergedOcc 0
11 mol 175 unq 0 iso 0 dist 7.2067 6.22904 6.53696 13.9562 11.158 8.99988 numMergedOcc 0
12 mol 175 unq 1 iso 0 dist 7.2067 6.22904 6.53696 8.92139 8.65486 6.99693 numMergedOcc 0
13 mol 234 unq 0 iso 0 dist 8.8978 6.2709 5.68253 10.8275 11.0142 9.25517 numMergedOcc 0
14 mol 234 unq 1 iso 0 dist 8.8978 6.2709 5.68253 12.8613 6.7061 7.22019 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 8.78008 5.41296 5.4347 9.10967 5.28695 7.02079 numMergedOcc 0
16 mol 253 unq 0 iso 0 dist 9.35766 10.5693 9.6479 19.873 15.4561 9.58354 numMergedOcc 0
17 mol 259 unq 0 iso 0 dist 9.16791 13.1939 9.69025 20.9701 15.1483 8.71497 numMergedOcc 0
18 mol 259 unq 1 iso 0 dist 8.38727 4.32336 8.02757 11.4584 5.84058 8.92185 numMergedOcc 0
19 mol 259 unq 2 iso 0 dist 8.38727 4.32336 8.02757 8.84139 5.36282 7.7574 numMergedOcc 0
20 mol 259 unq 3 iso 0 dist 6.6731 4.34105 8.02757 9.418 5.84058 8.92185 numMergedOcc 0
21 mol 259 unq 4 iso 0 dist 6.6731 4.34105 8.02757 9.26725 5.36282 7.7574 numMergedOcc 0
22 mol 259 unq 5 iso 0 dist 9.83696 11.2938 8.02757 8.10823 5.84058 8.92185 numMergedOcc 0
23 mol 259 unq 6 iso 0 dist 9.83696 11.2938 8.02757 12.1817 5.36282 7.7574 numMergedOcc 0
24 mol 265 unq 0 iso 0 dist 8.19772 11.7401 7.49913 12.5313 4.98228 5.40318 numMergedOcc 0
25 mol 279 unq 0 iso 0 dist 8.76889 4.99186 8.16582 6.10834 7.28266 9.24367 numMergedOcc 0
26 mol 279 unq 1 iso 0 dist 7.04397 8.17282 8.16582 8.24233 7.28266 9.24367 numMergedOcc 0
27 mol 294 unq 0 iso 0 dist 6.9719 9.61922 9.7659 12.0623 7.79284 7.36811 numMergedOcc 0
