0 mol 8 unq 0 iso 0 dist 4.92734 5.78687 4.04644 9.91124 7.3915 11.2536 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 4.92734 8.86323 9.90806 9.91124 7.3915 13.844 numMergedOcc 0
2 mol 13 unq 0 iso 0 dist 6.44408 9.89744 6.37276 6.00386 5.78148 11.486 numMergedOcc 0
3 mol 25 unq 0 iso 0 dist 6.23095 6.74298 5.52519 6.06832 5.81959 5.44124 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 7.51406 8.22533 9.57852 6.81213 5.69955 11.5481 numMergedOcc 0
5 mol 42 unq 0 iso 0 dist 6.86731 9.54121 5.65461 8.13252 9.16649 6.83373 numMergedOcc 0
6 mol 56 unq 0 iso 0 dist 8.96238 7.49284 11.2895 6.5705 6.77886 7.3576 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 8.88255 9.04565 15.5947 6.89245 7.77116 15.4077 numMergedOcc 0
8 mol 119 unq 1 iso 0 dist 8.88255 9.18306 15.7842 6.89245 7.77116 13.4603 numMergedOcc 0
9 mol 119 unq 2 iso 0 dist 7.85527 9.46689 4.72999 8.79034 6.98934 4.31261 numMergedOcc 0
10 mol 119 unq 3 iso 0 dist 7.85527 9.46689 4.72999 5.53632 7.99623 7.7186 numMergedOcc 0
11 mol 119 unq 4 iso 0 dist 7.85527 9.09931 4.45156 8.79034 6.98934 10.292 numMergedOcc 0
12 mol 119 unq 5 iso 0 dist 7.85527 9.09931 4.45156 5.53632 7.99623 11.1665 numMergedOcc 0
13 mol 205 unq 0 iso 0 dist 6.15806 8.09352 9.41884 6.37333 5.60393 6.61806 numMergedOcc 0
14 mol 227 unq 0 iso 0 dist 9.60159 9.98859 6.16261 11.2986 8.38865 13.7859 numMergedOcc 0
15 mol 232 unq 0 iso 0 dist 9.95045 8.24802 8.36582 16.7146 7.83711 12.0033 numMergedOcc 0
