0 mol 16 unq 0 iso 0 dist 7.72142 6.28033 5.59769 5.40044 8.47315 4.7319 9.9153 12.1062 6.51133 6.72833 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 8.46837 6.84569 6.43294 11.958 8.33883 10.9143 16.9822 10.2885 15.1671 6.93532 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 7.53564 9.17086 10.323 5.90113 9.74445 8.80331 11.9521 10.7304 6.18002 8.95682 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 6.10175 6.54183 10.1356 5.65405 5.59773 8.10861 8.60653 7.93241 5.99981 7.21717 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 7.84699 6.10011 8.04817 13.4367 6.89722 11.4799 13.2119 11.5412 8.44406 9.24757 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 7.84699 8.124 5.2774 13.4367 6.89722 6.19304 13.2119 11.5412 6.56633 9.24757 numMergedOcc 0
6 mol 73 unq 2 iso 0 dist 8.40844 6.10011 9.76331 13.4367 7.26679 11.4799 13.2119 11.2253 8.44406 9.24757 numMergedOcc 0
7 mol 73 unq 3 iso 0 dist 8.40844 8.124 5.44275 13.4367 7.26679 6.19304 13.2119 11.2253 6.56633 9.24757 numMergedOcc 0
8 mol 73 unq 4 iso 0 dist 7.02351 8.16299 11.2674 10.3774 7.26679 8.70481 14.1293 11.2253 15.3808 9.24757 numMergedOcc 0
9 mol 102 unq 0 iso 0 dist 9.61113 7.42187 13.5433 13.9809 9.01767 18.0405 18.7002 10.4216 20.9196 8.31932 numMergedOcc 0
10 mol 102 unq 1 iso 0 dist 7.59973 7.42187 8.51668 13.9809 9.80678 18.0405 18.7002 12.8733 20.9196 8.31932 numMergedOcc 0
11 mol 102 unq 2 iso 0 dist 7.73836 9.84673 6.42572 5.09542 9.01767 7.36792 11.4976 10.4216 7.42011 8.31932 numMergedOcc 0
12 mol 156 unq 0 iso 0 dist 6.67598 9.19499 5.0966 5.66289 7.30021 7.44554 10.6749 9.69888 5.71511 9.4013 numMergedOcc 0
13 mol 156 unq 1 iso 0 dist 6.67598 7.11647 5.75141 5.66289 7.30021 8.94056 10.6749 9.69888 6.13574 9.4013 numMergedOcc 0
14 mol 220 unq 0 iso 0 dist 8.58709 6.21273 4.90657 5.1021 9.8711 9.23153 7.58118 4.39102 7.11498 6.59716 numMergedOcc 0
15 mol 222 unq 0 iso 0 dist 7.10689 8.7419 8.81265 5.01062 8.7347 6.00706 13.4892 15.9714 7.75466 9.07471 numMergedOcc 0
16 mol 222 unq 1 iso 0 dist 7.10689 8.5834 4.28891 5.01062 8.7347 7.54212 13.4892 15.9714 13.3447 9.07471 numMergedOcc 0
17 mol 227 unq 0 iso 0 dist 7.99145 7.71761 11.4528 5.841 9.17826 7.55216 11.6367 16.3489 9.32448 7.43071 numMergedOcc 0
18 mol 227 unq 1 iso 0 dist 7.99145 7.71761 11.4528 5.841 9.17826 7.55216 6.65275 5.75236 6.48027 5.41321 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 4.21935 6.83046 5.29737 4.77446 6.37342 6.16342 10.3104 7.48655 4.30299 8.84636 numMergedOcc 0
20 mol 251 unq 0 iso 0 dist 8.65547 8.8487 6.91874 10.0672 9.82043 13.3555 10.7704 5.93645 7.02794 8.68707 numMergedOcc 0
