0 mol 24 unq 0 iso 0 dist 4.87192 7.18124 4.21283 3.4435 4.90592 7.85986 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 4.87192 7.18124 4.21283 7.63657 8.16324 11.0098 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 4.87192 6.47026 4.97191 3.4435 4.90592 4.30252 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 4.87192 6.47026 4.97191 7.63657 8.16324 12.496 numMergedOcc 0
4 mol 27 unq 0 iso 0 dist 7.43804 9.52155 8.59444 5.92112 7.45532 11.3725 numMergedOcc 0
5 mol 27 unq 1 iso 0 dist 7.43804 9.16319 4.3825 5.92112 7.45532 9.69276 numMergedOcc 0
6 mol 48 unq 0 iso 0 dist 5.01135 7.90364 5.15398 5.68596 7.59316 6.28603 numMergedOcc 0
7 mol 48 unq 1 iso 0 dist 5.20384 7.78518 5.15603 5.69576 7.51285 5.73454 numMergedOcc 0
8 mol 56 unq 0 iso 0 dist 7.3576 6.28905 3.91174 10.4286 6.99108 9.09425 numMergedOcc 0
9 mol 68 unq 0 iso 0 dist 5.44028 8.32093 13.0221 7.25845 6.40693 15.2743 numMergedOcc 0
10 mol 85 unq 0 iso 0 dist 6.00564 9.43843 14.3481 4.58085 8.70863 6.46549 numMergedOcc 0
11 mol 85 unq 1 iso 0 dist 6.00564 7.67463 4.06365 4.58085 8.70863 10.3185 numMergedOcc 0
12 mol 131 unq 0 iso 0 dist 8.34503 9.8911 4.9293 5.06665 5.39061 7.84546 numMergedOcc 0
13 mol 131 unq 1 iso 0 dist 5.70499 7.02043 4.9293 7.7998 5.39061 7.84546 numMergedOcc 0
14 mol 162 unq 0 iso 0 dist 6.00293 9.67872 5.21512 8.06906 7.14263 5.67088 numMergedOcc 0
15 mol 162 unq 1 iso 0 dist 6.00293 9.67872 5.21512 6.76865 8.57005 12.4379 numMergedOcc 0
16 mol 194 unq 0 iso 0 dist 7.39369 8.93352 10.0237 8.10654 5.68348 9.82667 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 5.96238 8.42716 6.72925 3.5693 5.95375 9.17562 numMergedOcc 0
18 mol 205 unq 1 iso 0 dist 8.24405 9.66947 7.1653 6.29383 5.95375 6.81516 numMergedOcc 0
19 mol 205 unq 2 iso 0 dist 8.24405 5.69652 6.72925 6.29383 5.95375 9.17562 numMergedOcc 0
20 mol 205 unq 3 iso 0 dist 7.85966 8.42716 10.2944 3.5693 9.17946 9.17562 numMergedOcc 0
21 mol 230 unq 0 iso 0 dist 7.81987 8.89873 8.20635 11.3876 8.34416 16.1656 numMergedOcc 0
22 mol 230 unq 1 iso 0 dist 7.81987 8.89873 8.20635 6.78617 6.34832 12.4872 numMergedOcc 0
