0 mol 16 unq 0 iso 0 dist 8.33883 5.77753 6.2983 5.38671 5.05803 7.03948 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 8.33883 5.77753 6.2983 5.45161 6.31718 5.47769 numMergedOcc 0
2 mol 16 unq 2 iso 0 dist 8.33883 5.77753 6.2983 6.43294 10.9143 6.58035 numMergedOcc 0
3 mol 73 unq 0 iso 0 dist 6.89722 6.4154 7.41074 10.4716 9.96396 8.70133 numMergedOcc 0
4 mol 73 unq 1 iso 0 dist 6.89722 6.4154 7.41074 8.04817 11.4799 5.64598 numMergedOcc 0
5 mol 73 unq 2 iso 0 dist 6.89722 6.4154 7.41074 5.2774 6.19304 4.65521 numMergedOcc 0
6 mol 102 unq 0 iso 0 dist 9.43411 9.50209 4.32286 5.54551 12.0341 9.94856 numMergedOcc 0
7 mol 102 unq 1 iso 0 dist 9.80678 9.50209 5.498 5.54551 7.36792 9.94856 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 6.86946 5.52706 5.60178 6.98664 11.8322 6.87861 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 6.86946 5.52706 5.60178 5.889 4.99221 6.50039 numMergedOcc 0
10 mol 127 unq 0 iso 0 dist 8.40046 8.03243 14.085 12.3873 17.6472 6.192 numMergedOcc 0
11 mol 127 unq 1 iso 0 dist 8.40046 8.03243 14.085 9.8591 15.0647 7.69308 numMergedOcc 0
12 mol 127 unq 2 iso 0 dist 8.40046 8.03243 14.085 9.75166 9.30299 8.59981 numMergedOcc 0
13 mol 127 unq 3 iso 0 dist 8.40046 8.03243 14.085 12.9471 14.7391 7.66331 numMergedOcc 0
14 mol 155 unq 0 iso 0 dist 7.02715 5.64806 5.77564 6.68061 11.6934 7.16254 numMergedOcc 0
15 mol 155 unq 1 iso 0 dist 7.02715 5.64806 5.77564 11.0287 13.4817 9.14392 numMergedOcc 0
16 mol 156 unq 0 iso 0 dist 9.16591 8.57453 4.53931 9.27577 9.83699 6.27641 numMergedOcc 0
17 mol 182 unq 0 iso 0 dist 7.86625 9.23118 11.1088 5.40949 9.31746 6.73313 numMergedOcc 0
18 mol 214 unq 0 iso 0 dist 8.49704 6.35728 6.67959 10.644 8.85478 7.46831 numMergedOcc 0
19 mol 214 unq 1 iso 0 dist 8.49704 6.35728 6.67959 4.82712 11.9355 8.60247 numMergedOcc 0
20 mol 222 unq 0 iso 0 dist 8.7347 5.04916 7.61682 4.28891 7.54212 7.18956 numMergedOcc 0
21 mol 224 unq 0 iso 0 dist 9.34636 8.60781 7.98696 5.63485 8.95269 6.87664 numMergedOcc 0
22 mol 224 unq 1 iso 0 dist 9.33771 6.4508 5.29877 5.41021 8.95269 6.67585 numMergedOcc 0
23 mol 224 unq 2 iso 0 dist 9.33771 6.4508 5.29877 4.91322 6.57273 6.65984 numMergedOcc 0
24 mol 224 unq 3 iso 0 dist 7.39839 6.4508 6.12232 5.41021 9.99123 6.67585 numMergedOcc 0
25 mol 224 unq 4 iso 0 dist 7.39839 6.4508 6.12232 4.91322 6.60589 6.65984 numMergedOcc 0
26 mol 224 unq 5 iso 0 dist 9.79616 8.60781 7.12232 5.63485 6.57273 6.87664 numMergedOcc 0
27 mol 227 unq 0 iso 0 dist 9.17826 8.34104 6.43754 14.9329 7.22101 8.17891 numMergedOcc 0
28 mol 227 unq 1 iso 0 dist 9.17826 8.34104 6.43754 13.2783 8.65997 6.95902 numMergedOcc 0
29 mol 259 unq 0 iso 0 dist 5.90381 5.70124 5.20486 11.9055 11.5135 6.77938 numMergedOcc 0
30 mol 264 unq 0 iso 0 dist 6.75305 9.67417 5.12409 10.0289 6.24356 9.0012 numMergedOcc 0
31 mol 274 unq 0 iso 0 dist 6.00877 5.42845 5.31116 13.002 10.7806 9.19234 numMergedOcc 0
32 mol 274 unq 1 iso 0 dist 8.66451 5.62484 5.31116 10.2307 10.7806 9.19234 numMergedOcc 0
33 mol 274 unq 2 iso 0 dist 9.696 5.12523 6.8406 5.1874 8.49997 7.97444 numMergedOcc 0
34 mol 282 unq 0 iso 0 dist 9.63346 5.2527 6.3384 4.85461 8.04483 6.85028 numMergedOcc 0
35 mol 282 unq 1 iso 0 dist 9.63346 5.2527 6.3384 8.85797 6.33524 7.32347 numMergedOcc 0
36 mol 282 unq 2 iso 0 dist 9.63346 5.2527 6.3384 5.43514 13.5481 8.3411 numMergedOcc 0
