0 mol 43 unq 0 iso 0 dist 7.81257 7.19567 5.74886 6.59001 5.19462 9.0979 numMergedOcc 0
1 mol 126 unq 0 iso 0 dist 9.88921 9.40595 12.2855 6.51437 14.1978 9.93116 numMergedOcc 0
2 mol 128 unq 0 iso 0 dist 9.36937 7.94925 5.2613 9.02609 4.93016 5.23695 numMergedOcc 0
3 mol 148 unq 0 iso 0 dist 9.31479 5.78662 7.07091 8.23396 12.8771 8.09064 numMergedOcc 0
4 mol 148 unq 1 iso 0 dist 9.52076 5.78662 5.37034 8.23396 13.0478 8.09064 numMergedOcc 0
5 mol 150 unq 0 iso 0 dist 9.50019 5.47823 7.1526 7.40922 12.7578 8.00956 numMergedOcc 0
6 mol 150 unq 1 iso 0 dist 9.44178 5.47823 5.33499 7.40922 12.9776 8.00956 numMergedOcc 0
7 mol 204 unq 0 iso 0 dist 9.05137 6.58174 10.8093 5.10199 13.3874 5.81438 numMergedOcc 0
8 mol 204 unq 1 iso 0 dist 6.69026 6.58174 9.85523 5.10199 9.63166 5.81438 numMergedOcc 0
9 mol 205 unq 0 iso 0 dist 9.6897 9.54443 4.79799 11.0071 7.63908 6.50586 numMergedOcc 0
10 mol 214 unq 0 iso 0 dist 8.61758 7.24175 10.8341 10.996 18.1704 8.44407 numMergedOcc 0
11 mol 214 unq 1 iso 0 dist 8.61758 7.24175 10.8341 5.055 12.9113 6.0155 numMergedOcc 0
12 mol 214 unq 2 iso 0 dist 8.61758 7.24175 10.8341 10.6488 8.9694 8.89981 numMergedOcc 0
13 mol 214 unq 3 iso 0 dist 5.45548 7.24175 9.47512 10.996 13.9749 8.44407 numMergedOcc 0
14 mol 214 unq 4 iso 0 dist 5.45548 7.24175 9.47512 5.055 8.70011 6.0155 numMergedOcc 0
15 mol 214 unq 5 iso 0 dist 5.45548 7.24175 9.47512 10.6488 13.3862 8.89981 numMergedOcc 0
16 mol 252 unq 0 iso 0 dist 8.98898 8.88435 11.2884 4.68897 11.421 9.52528 numMergedOcc 0
17 mol 266 unq 0 iso 0 dist 4.74121 8.78219 7.98429 8.86075 10.0829 7.97711 numMergedOcc 0
18 mol 287 unq 0 iso 0 dist 7.41656 4.98604 5.81104 5.04841 10.0337 6.06665 numMergedOcc 0
19 mol 288 unq 0 iso 0 dist 7.41656 4.98604 5.81104 5.04841 10.0337 6.06665 numMergedOcc 0
20 mol 289 unq 0 iso 0 dist 7.41656 4.98604 5.81104 5.04841 10.0337 6.06665 numMergedOcc 0
