0 mol 1 unq 0 iso 0 dist 9.19543 6.41817 9.69226 4.86523 9.40771 10.0996 numMergedOcc 0
1 mol 53 unq 0 iso 0 dist 6.22911 5.80996 6.40941 10.4416 6.6473 12.0788 numMergedOcc 0
2 mol 53 unq 1 iso 0 dist 6.76484 5.66861 6.40941 9.05584 6.6473 12.0788 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 7.1365 6.72703 3.98831 3.82305 9.80869 9.54323 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 6.69386 5.44722 10.2358 8.56267 9.51893 11.7927 numMergedOcc 0
5 mol 62 unq 1 iso 0 dist 6.69386 5.44722 10.2358 7.34856 8.47221 12.128 numMergedOcc 0
6 mol 91 unq 0 iso 0 dist 6.77052 7.74952 11.1564 12.0662 8.72835 17.6375 numMergedOcc 0
7 mol 100 unq 0 iso 0 dist 7.3098 8.22984 6.8344 9.06539 8.29463 14.2997 numMergedOcc 0
8 mol 100 unq 1 iso 0 dist 9.90038 6.6157 6.8344 14.1132 8.29463 14.2997 numMergedOcc 0
9 mol 158 unq 0 iso 0 dist 6.72322 7.13199 6.83901 3.96267 6.68721 9.97968 numMergedOcc 0
10 mol 186 unq 0 iso 0 dist 8.3417 9.38735 9.9497 8.73003 7.81696 14.7428 numMergedOcc 0
11 mol 186 unq 1 iso 0 dist 8.3417 8.89293 10.094 8.73003 7.81696 15.7057 numMergedOcc 0
12 mol 196 unq 0 iso 0 dist 7.21836 6.67699 7.68725 10.4797 4.48862 10.2274 numMergedOcc 0
13 mol 213 unq 0 iso 0 dist 5.08722 8.53661 10.3831 6.80603 9.27411 15.0946 numMergedOcc 0
14 mol 213 unq 1 iso 0 dist 5.08722 8.53661 10.3831 4.44853 5.81317 12.8565 numMergedOcc 0
15 mol 278 unq 0 iso 0 dist 6.25295 5.79682 4.19643 7.12222 9.90216 11.1004 numMergedOcc 0
16 mol 287 unq 0 iso 0 dist 7.80478 5.62568 8.18822 5.96447 9.98518 10.3645 numMergedOcc 0
17 mol 288 unq 0 iso 0 dist 7.80478 5.62568 8.18822 5.96447 9.98518 10.3645 numMergedOcc 0
18 mol 289 unq 0 iso 0 dist 7.80478 5.62568 8.18822 5.96447 9.98518 10.3645 numMergedOcc 0
19 mol 292 unq 0 iso 0 dist 7.78353 5.67671 4.34945 15.0419 9.18386 13.4707 numMergedOcc 0
