0 mol 16 unq 0 iso 0 dist 8.33883 5.77753 6.2983 5.45161 6.31718 5.47769 9.79958 10.8455 5.94084 7.63133 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 8.33883 5.77753 6.2983 6.43294 10.9143 6.58035 9.79958 10.8455 5.94084 5.46498 numMergedOcc 0
2 mol 73 unq 0 iso 0 dist 6.89722 6.4154 7.41074 10.4716 9.96396 8.70133 11.7436 15.7123 13.4082 9.38498 numMergedOcc 0
3 mol 73 unq 1 iso 0 dist 6.89722 6.4154 7.41074 10.4716 9.96396 8.70133 14.4206 12.016 15.9882 9.75218 numMergedOcc 0
4 mol 73 unq 2 iso 0 dist 6.89722 6.4154 7.41074 8.04817 11.4799 5.64598 11.905 16.5689 9.77992 5.93252 numMergedOcc 0
5 mol 102 unq 0 iso 0 dist 9.43411 9.50209 4.32286 5.54551 12.0341 9.94856 9.80678 9.15076 5.498 7.36792 numMergedOcc 0
6 mol 127 unq 0 iso 0 dist 8.40046 8.03243 14.085 9.75166 9.30299 8.59981 12.4824 7.30196 14.9761 8.14887 numMergedOcc 0
7 mol 155 unq 0 iso 0 dist 7.02715 5.64806 5.77564 6.68061 11.6934 7.16254 9.70079 12.1545 6.3845 6.23493 numMergedOcc 0
8 mol 155 unq 1 iso 0 dist 7.02715 5.64806 5.77564 11.0287 13.4817 9.14392 9.70079 12.1545 6.3845 7.46303 numMergedOcc 0
9 mol 155 unq 2 iso 0 dist 7.02715 5.64806 5.77564 11.0287 13.4817 9.14392 15.6872 17.3001 12.1814 6.43582 numMergedOcc 0
10 mol 156 unq 0 iso 0 dist 9.16591 8.57453 4.53931 9.27577 9.83699 6.27641 13.6067 8.38403 7.29758 7.44554 numMergedOcc 0
11 mol 156 unq 1 iso 0 dist 9.16591 8.57453 4.53931 9.27577 9.83699 6.27641 16.4964 11.2719 8.67156 8.94056 numMergedOcc 0
12 mol 224 unq 0 iso 0 dist 9.34636 8.60781 7.98696 5.63485 8.95269 6.87664 9.79616 4.70378 7.12232 6.57273 numMergedOcc 0
13 mol 224 unq 1 iso 0 dist 9.34636 8.60781 7.98696 5.63485 8.95269 6.87664 10.0081 11.5372 5.3621 5.78342 numMergedOcc 0
14 mol 224 unq 2 iso 0 dist 9.33771 6.4508 5.29877 4.91322 6.57273 6.65984 7.39839 5.0744 6.12232 6.60589 numMergedOcc 0
15 mol 224 unq 3 iso 0 dist 7.39839 6.4508 6.12232 5.41021 9.99123 6.67585 9.33771 5.0744 5.29877 8.95269 numMergedOcc 0
16 mol 224 unq 4 iso 0 dist 7.39839 6.4508 6.12232 4.91322 6.60589 6.65984 9.33771 5.0744 5.29877 6.57273 numMergedOcc 0
17 mol 224 unq 5 iso 0 dist 9.79616 8.60781 7.12232 5.63485 6.57273 6.87664 9.34636 4.70378 7.98696 8.95269 numMergedOcc 0
18 mol 224 unq 6 iso 0 dist 9.79616 8.60781 7.12232 5.63485 6.57273 6.87664 10.0081 8.49799 5.3621 5.78342 numMergedOcc 0
19 mol 227 unq 0 iso 0 dist 9.17826 8.34104 6.43754 14.9329 7.22101 8.17891 13.0242 4.39704 9.13836 7.09863 numMergedOcc 0
20 mol 259 unq 0 iso 0 dist 5.90381 5.70124 5.20486 11.9055 11.5135 6.77938 10.5558 8.00116 4.99891 5.30224 numMergedOcc 0
21 mol 264 unq 0 iso 0 dist 6.75305 9.67417 5.12409 10.0289 6.24356 9.0012 16.8589 10.3202 9.74238 9.361 numMergedOcc 0
