0 mol 70 unq 0 iso 0 dist 9.49626 8.9375 9.34122 10.487 6.93285 5.48202 numMergedOcc 0
1 mol 95 unq 0 iso 0 dist 8.49531 6.33328 8.67367 8.6356 12.6805 9.51981 numMergedOcc 0
2 mol 102 unq 0 iso 0 dist 8.84131 6.87786 9.94856 9.00369 3.48119 7.68537 numMergedOcc 0
3 mol 142 unq 0 iso 0 dist 8.86346 9.01957 7.15475 10.3674 4.05822 5.69323 numMergedOcc 0
4 mol 142 unq 1 iso 0 dist 4.93681 6.17441 7.15475 6.4119 4.05822 5.69323 numMergedOcc 0
5 mol 176 unq 0 iso 0 dist 8.78509 12.1262 8.61331 13.811 6.40668 9.67312 numMergedOcc 0
6 mol 197 unq 0 iso 0 dist 7.70631 14.5382 8.99696 18.7364 11.9685 9.77656 numMergedOcc 0
7 mol 197 unq 1 iso 0 dist 7.70631 14.5382 8.99696 22.535 16.9912 9.6071 numMergedOcc 0
8 mol 218 unq 0 iso 0 dist 8.95233 12.6102 7.13323 19.2468 11.7256 8.5244 numMergedOcc 0
9 mol 222 unq 0 iso 0 dist 7.88846 5.66378 7.18956 12.0326 5.2269 9.29675 numMergedOcc 0
10 mol 235 unq 0 iso 0 dist 6.45574 5.61388 8.21247 8.28824 4.75609 9.11149 numMergedOcc 0
11 mol 235 unq 1 iso 0 dist 8.14407 6.59128 8.21247 11.7046 4.75609 9.11149 numMergedOcc 0
12 mol 256 unq 0 iso 0 dist 9.51272 9.94758 8.09363 12.0759 4.6374 5.85613 numMergedOcc 0
13 mol 264 unq 0 iso 0 dist 7.37999 11.2015 9.5784 10.3888 11.147 8.56867 numMergedOcc 0
14 mol 264 unq 1 iso 0 dist 7.37999 11.2015 9.5784 10.9327 10.0018 6.29872 numMergedOcc 0
15 mol 264 unq 2 iso 0 dist 7.36703 10.3867 9.5784 14.5694 11.147 8.56867 numMergedOcc 0
16 mol 264 unq 3 iso 0 dist 7.36703 10.3867 9.5784 13.6622 10.0018 6.29872 numMergedOcc 0
17 mol 265 unq 0 iso 0 dist 8.49415 9.3596 6.34034 5.44039 7.71667 8.03604 numMergedOcc 0
18 mol 277 unq 0 iso 0 dist 7.23956 12.9898 9.41725 13.087 7.75371 9.62597 numMergedOcc 0
