0 mol 26 unq 0 iso 0 dist 5.58467 9.15677 7.42841 6.71239 8.51396 14.1531 16.4682 12.7979 8.34347 19.5266 numMergedOcc 0
1 mol 66 unq 0 iso 0 dist 7.48714 7.69019 6.66235 6.5549 9.07446 12.9393 5.89221 10.3005 8.96624 11.0251 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 4.79868 9.74268 9.69588 9.56692 9.64018 16.3384 6.95018 10.1127 9.65964 10.4051 numMergedOcc 0
3 mol 70 unq 1 iso 0 dist 4.79868 9.74268 9.69588 4.85973 7.49737 10.0194 6.95018 10.1127 9.65964 10.1702 numMergedOcc 0
4 mol 175 unq 0 iso 0 dist 7.01007 8.50904 9.78176 8.66364 6.24096 14.9267 8.09861 10.7272 9.0018 12.4148 numMergedOcc 0
5 mol 175 unq 1 iso 0 dist 7.01007 8.50904 9.78176 8.66364 6.24096 14.9267 10.1323 14.7648 7.652 17.7615 numMergedOcc 0
6 mol 175 unq 2 iso 0 dist 7.01007 7.04318 6.15969 8.66364 6.24096 10.2436 8.09861 10.7272 5.6234 12.4148 numMergedOcc 0
7 mol 175 unq 3 iso 0 dist 7.01007 7.04318 6.15969 8.66364 6.24096 10.2436 10.1323 14.7648 9.92231 17.7615 numMergedOcc 0
8 mol 182 unq 0 iso 0 dist 5.16184 6.31492 5.40949 7.7168 9.72584 11.7478 7.48422 7.86625 9.31746 3.8657 numMergedOcc 0
9 mol 182 unq 1 iso 0 dist 8.54162 7.8621 5.40949 10.8463 9.72584 11.7478 6.98787 7.86625 9.31746 3.8657 numMergedOcc 0
10 mol 210 unq 0 iso 0 dist 8.87835 7.19917 5.82028 16.8336 8.78286 13.451 9.55205 9.67457 6.18308 17.8124 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 4.58449 8.93637 6.24624 4.87397 8.81279 12.785 14.8074 13.1834 9.23153 19.1462 numMergedOcc 0
12 mol 220 unq 1 iso 0 dist 7.03223 8.93637 6.02282 4.87397 9.57951 12.785 14.8074 11.004 9.23153 19.1462 numMergedOcc 0
13 mol 222 unq 0 iso 0 dist 9.91243 7.14277 5.66819 11.6667 6.16787 10.8618 4.02914 11.0097 7.21333 14.0617 numMergedOcc 0
14 mol 261 unq 0 iso 0 dist 8.9569 7.26647 15.1428 7.35121 9.6169 13.8596 4.95196 11.6093 7.73141 10.7863 numMergedOcc 0
15 mol 261 unq 1 iso 0 dist 8.9569 7.26647 15.1428 7.35121 9.6169 13.8596 9.29412 17.9341 8.43057 11.6095 numMergedOcc 0
16 mol 261 unq 2 iso 0 dist 8.9569 7.7309 15.7709 7.35121 9.6169 12.1837 9.29412 17.9341 6.05727 11.6095 numMergedOcc 0
17 mol 282 unq 0 iso 0 dist 9.40138 7.70229 4.58403 11.3627 8.69145 10.4729 8.93697 5.67266 8.76532 10.3469 numMergedOcc 0
18 mol 282 unq 1 iso 0 dist 9.40138 7.90792 5.04235 11.3627 8.69145 12.7604 8.93697 5.67266 6.33524 10.3469 numMergedOcc 0
