0 mol 7 unq 0 iso 0 dist 4.47024 4.91115 8.60435 9.89388 12.4861 6.14469 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 8.29595 14.2823 6.59455 20.6451 13.7528 7.35972 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 7.26523 12.9719 8.00369 14.3572 7.99067 5.59965 numMergedOcc 0
3 mol 11 unq 0 iso 0 dist 8.09534 6.24549 8.70462 10.1657 7.18398 7.5459 numMergedOcc 0
4 mol 11 unq 1 iso 0 dist 7.93279 6.07735 8.7143 9.99647 7.51068 7.5459 numMergedOcc 0
5 mol 19 unq 0 iso 0 dist 9.23617 12.9223 6.39966 21.9482 13.9675 9.95212 numMergedOcc 0
6 mol 19 unq 1 iso 0 dist 8.59114 10.8426 6.39966 20.3266 13.9675 9.95212 numMergedOcc 0
7 mol 19 unq 2 iso 0 dist 8.63204 10.5195 6.39966 12.8718 13.9675 9.95212 numMergedOcc 0
8 mol 24 unq 0 iso 0 dist 4.61828 10.7574 9.69752 13.4332 11.9395 8.00171 numMergedOcc 0
9 mol 24 unq 1 iso 0 dist 4.61828 12.8157 9.36461 13.4332 11.9395 6.72323 numMergedOcc 0
10 mol 26 unq 0 iso 0 dist 6.93801 7.46244 6.74848 8.98417 5.45023 6.56527 numMergedOcc 0
11 mol 60 unq 0 iso 0 dist 7.4674 9.42123 4.65127 10.6158 4.82351 8.97364 numMergedOcc 0
12 mol 60 unq 1 iso 0 dist 8.4928 11.6385 4.65127 8.04272 4.82351 8.97364 numMergedOcc 0
13 mol 114 unq 0 iso 0 dist 7.73842 14.9324 9.35942 13.1892 10.5177 8.42878 numMergedOcc 0
14 mol 171 unq 0 iso 0 dist 6.81707 6.4423 8.1536 6.4751 9.18337 5.25109 numMergedOcc 0
15 mol 171 unq 1 iso 0 dist 6.81707 6.4423 8.1536 5.75085 8.83874 8.21618 numMergedOcc 0
16 mol 194 unq 0 iso 0 dist 8.63008 4.44921 5.68348 8.09776 7.50057 6.38324 numMergedOcc 0
17 mol 194 unq 1 iso 0 dist 8.63008 4.44921 5.68348 5.4455 5.92931 6.1886 numMergedOcc 0
18 mol 220 unq 0 iso 0 dist 9.3439 9.91189 6.51288 11.1483 3.95218 9.73541 numMergedOcc 0
19 mol 250 unq 0 iso 0 dist 5.43238 4.45246 5.93798 13.5956 12.4255 9.70149 numMergedOcc 0
