0 mol 4 unq 0 iso 0 dist 9.15878 12.7019 5.39008 10.6508 9.12428 12.7044 numMergedOcc 0
1 mol 5 unq 0 iso 0 dist 8.70824 4.91776 6.81899 11.97 9.17088 7.12113 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 9.76585 14.0003 7.67459 10.0424 9.21978 6.30607 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 9.76585 14.0003 7.67459 12.7554 8.03754 9.69698 numMergedOcc 0
4 mol 55 unq 0 iso 0 dist 8.95571 10.0549 9.34552 5.39888 8.02261 11.7927 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 6.69184 13.1841 6.7939 8.59095 7.23812 10.3774 numMergedOcc 0
6 mol 73 unq 1 iso 0 dist 6.69184 13.1841 6.7939 6.90539 5.36012 10.539 numMergedOcc 0
7 mol 73 unq 2 iso 0 dist 6.69184 6.94793 8.44695 8.59095 7.23812 12.6626 numMergedOcc 0
8 mol 73 unq 3 iso 0 dist 6.69184 6.94793 8.44695 6.90539 5.36012 7.03229 numMergedOcc 0
9 mol 73 unq 4 iso 0 dist 6.69184 4.5646 5.68894 8.59095 7.23812 9.64124 numMergedOcc 0
10 mol 73 unq 5 iso 0 dist 6.69184 4.5646 5.68894 6.90539 5.36012 4.91508 numMergedOcc 0
11 mol 73 unq 6 iso 0 dist 8.73093 8.84457 8.08507 8.60018 6.4104 9.8979 numMergedOcc 0
12 mol 73 unq 7 iso 0 dist 8.02104 10.8656 8.08507 7.06343 6.4104 9.8979 numMergedOcc 0
13 mol 133 unq 0 iso 0 dist 9.48694 10.8724 4.73804 16.0605 9.19659 7.72006 numMergedOcc 0
14 mol 133 unq 1 iso 0 dist 9.56319 6.70307 5.92836 14.4095 9.47554 14.5299 numMergedOcc 0
15 mol 133 unq 2 iso 0 dist 6.65267 6.70307 4.73804 4.45869 9.19659 7.72006 numMergedOcc 0
16 mol 133 unq 3 iso 0 dist 9.73038 12.974 5.92836 5.37072 9.47554 14.5299 numMergedOcc 0
17 mol 133 unq 4 iso 0 dist 5.84909 10.3667 9.82274 5.36939 9.1146 15.3123 numMergedOcc 0
18 mol 133 unq 5 iso 0 dist 5.84909 5.91102 9.02712 5.36939 9.1146 10.4303 numMergedOcc 0
19 mol 152 unq 0 iso 0 dist 9.66811 6.72526 9.27341 13.3909 8.41774 9.50073 numMergedOcc 0
20 mol 155 unq 0 iso 0 dist 8.02356 6.16281 9.06599 5.01007 8.57712 4.97552 numMergedOcc 0
21 mol 156 unq 0 iso 0 dist 5.96301 6.8863 5.50879 5.73422 8.50926 10.9993 numMergedOcc 0
22 mol 156 unq 1 iso 0 dist 5.96301 7.61274 6.69157 5.73422 8.50926 4.75264 numMergedOcc 0
23 mol 158 unq 0 iso 0 dist 8.80952 9.41162 8.95432 6.84127 9.99005 3.8949 numMergedOcc 0
24 mol 172 unq 0 iso 0 dist 8.03804 8.4248 7.77643 8.00989 9.18538 5.78278 numMergedOcc 0
25 mol 172 unq 1 iso 0 dist 8.03804 8.74106 4.90175 8.00989 9.18538 5.25252 numMergedOcc 0
26 mol 212 unq 0 iso 0 dist 8.09185 9.60101 7.98724 6.89695 9.55058 6.09177 numMergedOcc 0
27 mol 212 unq 1 iso 0 dist 7.27225 14.4351 7.98724 13.2173 9.55058 6.09177 numMergedOcc 0
28 mol 212 unq 2 iso 0 dist 8.14212 11.1018 7.98724 7.25611 9.55058 6.09177 numMergedOcc 0
29 mol 238 unq 0 iso 0 dist 5.83514 5.12308 7.75366 5.65577 4.80834 10.1036 numMergedOcc 0
30 mol 239 unq 0 iso 0 dist 4.53228 4.53635 7.10828 8.37622 7.78671 12.7533 numMergedOcc 0
31 mol 239 unq 1 iso 0 dist 8.54078 9.93977 7.10828 5.55494 7.78671 12.7533 numMergedOcc 0
32 mol 241 unq 0 iso 0 dist 8.48816 7.31626 8.89435 14.2691 7.73213 10.0597 numMergedOcc 0
33 mol 271 unq 0 iso 0 dist 6.96986 5.03107 5.76281 8.72109 9.42899 5.31774 numMergedOcc 0
34 mol 274 unq 0 iso 0 dist 7.8547 6.64327 8.76302 4.4049 8.41236 6.00593 numMergedOcc 0
35 mol 274 unq 1 iso 0 dist 7.8547 14.7137 9.11322 4.4049 8.41236 12.4287 numMergedOcc 0
36 mol 276 unq 0 iso 0 dist 9.51555 6.22718 5.54217 11.3442 8.15803 6.02816 numMergedOcc 0
