0 mol 78 unq 0 iso 0 dist 5.8409 11.3406 9.53794 9.08675 9.4486 18.0271 numMergedOcc 0
1 mol 78 unq 1 iso 0 dist 5.8409 11.8939 9.84346 9.08675 9.4486 18.5554 numMergedOcc 0
2 mol 88 unq 0 iso 0 dist 7.33521 9.94542 8.00003 8.56449 9.73165 5.99589 numMergedOcc 0
3 mol 113 unq 0 iso 0 dist 6.28645 9.33151 9.64281 5.95402 5.37302 9.01097 numMergedOcc 0
4 mol 114 unq 0 iso 0 dist 5.99873 4.64006 8.53731 7.46008 8.27794 5.21101 numMergedOcc 0
5 mol 119 unq 0 iso 0 dist 8.08733 10.6776 7.72434 10.2818 8.4733 13.0801 numMergedOcc 0
6 mol 119 unq 1 iso 0 dist 4.90449 5.90092 7.72434 10.6827 8.4733 13.0801 numMergedOcc 0
7 mol 169 unq 0 iso 0 dist 6.57161 9.48174 9.83308 6.08318 5.51388 9.12553 numMergedOcc 0
8 mol 169 unq 1 iso 0 dist 6.57161 8.6142 8.97159 6.08318 5.51388 12.8642 numMergedOcc 0
9 mol 171 unq 0 iso 0 dist 7.7195 12.6444 8.59783 5.70195 6.80086 13.1204 numMergedOcc 0
10 mol 171 unq 1 iso 0 dist 8.30819 7.0159 8.59783 9.77016 6.80086 13.1204 numMergedOcc 0
11 mol 195 unq 0 iso 0 dist 9.78043 5.9265 8.97651 6.6068 8.13947 4.13357 numMergedOcc 0
12 mol 210 unq 0 iso 0 dist 5.07395 9.36636 9.718 9.20716 9.26092 9.53964 numMergedOcc 0
13 mol 210 unq 1 iso 0 dist 5.07395 8.95284 8.61629 9.20716 9.26092 5.82101 numMergedOcc 0
14 mol 210 unq 2 iso 0 dist 9.35577 9.32735 9.718 13.7915 9.26092 9.53964 numMergedOcc 0
15 mol 210 unq 3 iso 0 dist 9.35577 11.286 8.61629 13.7915 9.26092 5.82101 numMergedOcc 0
16 mol 226 unq 0 iso 0 dist 9.8767 12.9767 9.37229 5.9053 7.04477 13.3145 numMergedOcc 0
17 mol 253 unq 0 iso 0 dist 7.77279 10.8942 5.86892 4.71534 9.34735 13.3151 numMergedOcc 0
18 mol 292 unq 0 iso 0 dist 6.84909 12.2904 8.35169 10.6051 6.68863 9.58852 numMergedOcc 0
