0 mol 54 unq 0 iso 0 dist 4.22514 9.45804 6.10175 4.11549 6.29755 12.1689 10.5096 10.4221 15.9025 8.16246 numMergedOcc 0
1 mol 54 unq 1 iso 0 dist 4.22514 9.45804 6.10175 8.12687 7.4038 11.8364 10.5096 10.4221 15.9025 9.48823 numMergedOcc 0
2 mol 99 unq 0 iso 0 dist 8.6659 7.05715 8.23566 6.04335 4.82346 4.74328 12.4775 8.61334 6.81741 8.68674 numMergedOcc 0
3 mol 103 unq 0 iso 0 dist 5.37345 7.24416 8.28948 10.1051 8.88401 5.07523 14.3497 10.503 11.1265 6.79959 numMergedOcc 0
4 mol 140 unq 0 iso 0 dist 8.6371 4.56374 9.74209 4.46614 6.55217 4.8476 12.9378 5.90456 12.7279 9.13339 numMergedOcc 0
5 mol 140 unq 1 iso 0 dist 8.6371 4.56374 9.74209 4.46614 6.55217 4.8476 8.72216 5.00766 8.05043 7.60956 numMergedOcc 0
6 mol 140 unq 2 iso 0 dist 8.6371 4.56374 9.74209 4.74205 7.21686 8.53976 8.72216 5.00766 8.05043 9.9171 numMergedOcc 0
7 mol 229 unq 0 iso 0 dist 9.69083 5.0114 8.86628 6.60289 9.42877 6.1732 9.79447 6.40216 10.0705 6.28935 numMergedOcc 0
8 mol 239 unq 0 iso 0 dist 9.85256 7.07676 8.78008 4.72952 7.80073 8.20191 10.4134 10.1043 6.00654 8.86185 numMergedOcc 0
9 mol 249 unq 0 iso 0 dist 6.23348 4.77887 6.04688 6.0731 5.70674 4.88298 9.23283 6.13333 7.58833 3.67935 numMergedOcc 0
10 mol 255 unq 0 iso 0 dist 8.17286 4.80227 6.61193 4.52659 7.16286 6.41518 5.84157 12.1115 10.6136 7.57779 numMergedOcc 0
11 mol 280 unq 0 iso 0 dist 7.11605 11.1583 9.047 7.87626 6.38295 14.0927 7.60676 5.846 14.6209 4.45141 numMergedOcc 0
12 mol 280 unq 1 iso 0 dist 7.11605 15.3737 9.9227 7.87626 6.38295 11.4101 7.60676 5.846 13.7994 4.45141 numMergedOcc 0
13 mol 287 unq 0 iso 0 dist 8.72085 13.563 8.75275 5.05806 9.84741 13.9343 9.04355 7.43524 14.1883 6.96774 numMergedOcc 0
14 mol 288 unq 0 iso 0 dist 8.72085 13.563 8.75275 5.05806 9.84741 13.9343 9.04355 7.43524 14.1883 6.96774 numMergedOcc 0
15 mol 289 unq 0 iso 0 dist 8.72085 13.563 8.75275 5.05806 9.84741 13.9343 9.04355 7.43524 14.1883 6.96774 numMergedOcc 0
