0 mol 26 unq 0 iso 0 dist 8.11402 7.89222 4.98603 12.8104 9.25649 12.2636 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.11402 7.89222 4.98603 10.8584 9.36104 13.7693 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 7.60482 6.72703 6.56778 5.92019 5.86571 6.99108 numMergedOcc 0
3 mol 90 unq 0 iso 0 dist 8.71991 8.54821 4.48233 7.4595 7.54496 7.31784 numMergedOcc 0
4 mol 120 unq 0 iso 0 dist 8.16773 8.41086 4.51697 6.69527 8.43028 6.03352 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 6.23023 9.32254 6.15037 5.90381 7.59814 7.82544 numMergedOcc 0
6 mol 133 unq 1 iso 0 dist 6.23023 9.32254 6.15037 8.60202 9.7775 6.18808 numMergedOcc 0
7 mol 148 unq 0 iso 0 dist 4.7785 9.92375 7.81802 3.97123 8.12589 11.5523 numMergedOcc 0
8 mol 192 unq 0 iso 0 dist 8.15486 7.27051 8.38671 6.93447 8.53433 10.3117 numMergedOcc 0
9 mol 192 unq 1 iso 0 dist 8.15486 7.35424 11.0721 6.93447 8.53433 12.6156 numMergedOcc 0
10 mol 250 unq 0 iso 0 dist 8.4419 9.5174 4.45194 9.67078 9.03319 5.93798 numMergedOcc 0
11 mol 272 unq 0 iso 0 dist 5.84116 8.16917 5.42668 12.6613 6.98048 8.13034 numMergedOcc 0
12 mol 278 unq 0 iso 0 dist 7.05438 9.58671 11.3687 5.37654 9.80746 7.21972 numMergedOcc 0
