0 mol 54 unq 0 iso 0 dist 6.53191 5.40129 5.38191 6.94712 5.60003 7.16132 numMergedOcc 0
1 mol 59 unq 0 iso 0 dist 9.92545 5.63684 6.48625 11.1847 11.1377 6.56212 numMergedOcc 0
2 mol 108 unq 0 iso 0 dist 8.92763 15.6191 7.29462 20.7299 11.975 7.93045 numMergedOcc 0
3 mol 109 unq 0 iso 0 dist 8.35267 10.4339 6.31633 14.8561 6.54844 9.77497 numMergedOcc 0
4 mol 109 unq 1 iso 0 dist 8.35267 4.91393 7.21115 6.62354 7.53568 9.89083 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 8.34402 10.5271 9.4473 16.7909 12.9426 7.22643 numMergedOcc 0
6 mol 133 unq 1 iso 0 dist 8.07957 16.9748 9.4473 18.6527 12.9426 7.22643 numMergedOcc 0
7 mol 182 unq 0 iso 0 dist 9.68167 5.4214 7.86625 8.4603 4.82437 9.56028 numMergedOcc 0
8 mol 222 unq 0 iso 0 dist 8.81385 6.17038 8.7347 11.0981 15.1289 6.74196 numMergedOcc 0
9 mol 222 unq 1 iso 0 dist 8.81385 6.17038 8.7347 14.5172 13.6078 8.36842 numMergedOcc 0
10 mol 222 unq 2 iso 0 dist 8.81385 6.17038 8.7347 15.5123 13.6261 9.75472 numMergedOcc 0
11 mol 235 unq 0 iso 0 dist 9.50104 7.64039 7.2346 11.507 5.39025 5.1823 numMergedOcc 0
12 mol 235 unq 1 iso 0 dist 9.50104 7.64039 7.2346 8.75776 4.3433 5.70635 numMergedOcc 0
13 mol 257 unq 0 iso 0 dist 8.71571 7.16436 8.69184 11.2274 6.70515 6.34915 numMergedOcc 0
14 mol 257 unq 1 iso 0 dist 8.71571 5.85328 8.18901 11.2274 6.70515 7.81897 numMergedOcc 0
15 mol 277 unq 0 iso 0 dist 5.73065 13.2922 9.02914 18.31 13.3706 5.46926 numMergedOcc 0
16 mol 277 unq 1 iso 0 dist 5.73065 13.2922 9.02914 16.842 12.1739 5.13913 numMergedOcc 0
17 mol 277 unq 2 iso 0 dist 5.73065 11.9195 6.90434 12.0985 8.51268 9.35539 numMergedOcc 0
18 mol 277 unq 3 iso 0 dist 5.73065 11.9195 6.90434 18.31 13.3706 8.9682 numMergedOcc 0
19 mol 277 unq 4 iso 0 dist 5.73065 11.9195 6.90434 16.842 12.1739 6.92711 numMergedOcc 0
