0 mol 6 unq 0 iso 0 dist 7.8489 7.13004 11.3724 6.27506 9.38351 10.7954 numMergedOcc 0
1 mol 18 unq 0 iso 0 dist 4.70023 9.74802 5.867 6.54468 7.9504 8.93025 numMergedOcc 0
2 mol 94 unq 0 iso 0 dist 8.30482 9.09071 4.4432 11.6391 6.91081 5.20598 numMergedOcc 0
3 mol 99 unq 0 iso 0 dist 5.64099 9.43616 10.9042 10.8479 8.44207 17.8211 numMergedOcc 0
4 mol 99 unq 1 iso 0 dist 5.64099 8.43048 9.91993 10.8479 8.44207 17.9713 numMergedOcc 0
5 mol 141 unq 0 iso 0 dist 6.4822 9.23448 7.03121 10.3593 9.28415 7.82011 numMergedOcc 0
6 mol 141 unq 1 iso 0 dist 6.4822 5.83972 5.65619 10.3593 9.28415 12.1389 numMergedOcc 0
7 mol 147 unq 0 iso 0 dist 8.94007 7.88785 4.30798 7.24521 9.21476 11.034 numMergedOcc 0
8 mol 187 unq 0 iso 0 dist 8.45366 6.00248 5.94354 11.1486 5.82577 7.9625 numMergedOcc 0
9 mol 234 unq 0 iso 0 dist 5.67249 5.99388 4.21173 5.58711 9.24066 11.004 numMergedOcc 0
10 mol 252 unq 0 iso 0 dist 9.15686 8.16932 13.4808 5.96422 8.99368 11.6136 numMergedOcc 0
11 mol 252 unq 1 iso 0 dist 9.15686 6.94065 4.38445 5.96422 8.99368 6.45422 numMergedOcc 0
12 mol 272 unq 0 iso 0 dist 6.20857 6.76991 6.83359 12.7454 9.52059 7.06971 numMergedOcc 0
