0 mol 91 unq 0 iso 0 dist 7.47827 3.98211 9.30539 8.48295 10.2967 5.51406 14.4549 19.1264 11.5684 9.83906 numMergedOcc 0
1 mol 92 unq 0 iso 0 dist 5.89394 10.9738 6.95572 9.28919 4.52119 9.18898 5.73112 4.98104 9.52463 5.74364 numMergedOcc 0
2 mol 92 unq 1 iso 0 dist 5.89394 10.9738 6.95572 9.28919 4.52119 9.18898 15.1516 10.7379 9.30089 8.60026 numMergedOcc 0
3 mol 92 unq 2 iso 0 dist 5.89394 10.3703 7.38677 9.28919 4.52119 7.67331 5.73112 4.98104 6.07224 5.74364 numMergedOcc 0
4 mol 92 unq 3 iso 0 dist 5.89394 10.3703 7.38677 9.28919 4.52119 7.67331 15.1516 10.7379 5.77554 8.60026 numMergedOcc 0
5 mol 109 unq 0 iso 0 dist 8.91837 5.61989 6.60933 13.8996 11.1132 8.48774 7.45923 11.5807 6.14126 9.79844 numMergedOcc 0
6 mol 148 unq 0 iso 0 dist 9.7168 8.40891 8.18085 8.6499 12.8573 9.80819 9.82008 17.3468 12.193 6.60739 numMergedOcc 0
7 mol 148 unq 1 iso 0 dist 9.7168 8.40891 8.18085 8.6499 12.8573 9.80819 7.50382 16.4612 14.6053 9.22427 numMergedOcc 0
8 mol 148 unq 2 iso 0 dist 9.7168 8.40891 8.18085 8.6499 12.8573 9.80819 12.5069 16.7687 11.2269 5.55129 numMergedOcc 0
9 mol 150 unq 0 iso 0 dist 9.61132 8.32178 7.94889 8.75339 12.8265 9.81665 9.83293 17.2596 12.1772 6.71763 numMergedOcc 0
10 mol 150 unq 1 iso 0 dist 9.61132 8.32178 7.94889 8.75339 12.8265 9.81665 7.48524 16.3796 14.5231 9.32504 numMergedOcc 0
11 mol 150 unq 2 iso 0 dist 9.61132 8.32178 7.94889 8.75339 12.8265 9.81665 12.4366 16.6473 11.1674 5.53778 numMergedOcc 0
12 mol 181 unq 0 iso 0 dist 6.07676 6.10683 6.59025 8.67838 4.11061 6.95568 6.18164 6.00053 5.87168 4.96259 numMergedOcc 0
13 mol 181 unq 1 iso 0 dist 9.25528 15.4597 8.90963 16.4873 9.47799 5.66363 19.9851 11.2315 9.21613 6.13872 numMergedOcc 0
14 mol 204 unq 0 iso 0 dist 7.92766 15.254 9.68728 23.5549 18.2283 8.62191 19.7087 15.2431 6.08392 5.67196 numMergedOcc 0
15 mol 258 unq 0 iso 0 dist 7.22378 4.39424 7.21311 10.9873 6.48867 8.63176 11.8414 12.9664 8.01004 9.4886 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 7.28096 12.4113 6.89451 15.5038 8.60619 8.42076 14.7972 10.9612 13.6869 8.34389 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 7.28096 12.4113 6.89451 15.5038 8.60619 8.42076 14.7972 10.9612 13.6869 8.34389 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 7.28096 12.4113 6.89451 15.5038 8.60619 8.42076 14.7972 10.9612 13.6869 8.34389 numMergedOcc 0
