0 mol 26 unq 0 iso 0 dist 8.85591 5.88467 9.25649 9.67576 9.69957 9.36104 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.67576 5.88467 9.36104 8.85591 9.69957 9.25649 numMergedOcc 0
2 mol 94 unq 0 iso 0 dist 7.13726 4.4432 9.13207 9.37832 11.6491 5.18655 numMergedOcc 0
3 mol 130 unq 0 iso 0 dist 7.62584 4.9574 6.42785 11.6586 11.074 6.82089 numMergedOcc 0
4 mol 130 unq 1 iso 0 dist 7.39532 6.53156 6.42785 6.62468 11.074 6.82089 numMergedOcc 0
5 mol 130 unq 2 iso 0 dist 6.62468 6.53156 6.82089 7.39532 11.074 6.42785 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 9.19335 10.2495 7.59814 8.5076 7.27688 9.7775 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 8.5076 10.2495 9.7775 9.19335 7.27688 7.59814 numMergedOcc 0
8 mol 140 unq 0 iso 0 dist 8.73523 6.63467 8.06396 7.85653 10.6588 8.01587 numMergedOcc 0
9 mol 140 unq 1 iso 0 dist 7.85653 6.63467 8.01587 8.73523 10.6588 8.06396 numMergedOcc 0
10 mol 175 unq 0 iso 0 dist 9.12296 10.3187 7.01126 10.172 7.07861 6.58434 numMergedOcc 0
11 mol 213 unq 0 iso 0 dist 8.91912 6.58235 7.37935 13.2695 10.4306 7.78247 numMergedOcc 0
12 mol 218 unq 0 iso 0 dist 9.86462 6.34706 6.23898 12.518 6.52821 6.86795 numMergedOcc 0
13 mol 237 unq 0 iso 0 dist 9.74081 9.68452 7.35569 13.28 4.30138 9.2604 numMergedOcc 0
14 mol 252 unq 0 iso 0 dist 5.22349 7.31906 6.57207 9.81593 8.15279 5.2361 numMergedOcc 0
15 mol 252 unq 1 iso 0 dist 9.81593 7.31906 5.2361 5.22349 8.15279 6.57207 numMergedOcc 0
16 mol 252 unq 2 iso 0 dist 9.78248 12.8039 5.2361 17.7576 8.15279 6.57207 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 5.70326 7.49914 6.73126 11.298 6.33096 7.25677 numMergedOcc 0
