0 mol 30 unq 0 iso 0 dist 9.46036 5.61567 11.5376 10.3553 19.6046 9.66847 numMergedOcc 0
1 mol 92 unq 0 iso 0 dist 5.57712 9.43496 12.6233 12.5193 17.1821 9.48388 numMergedOcc 0
2 mol 108 unq 0 iso 0 dist 5.52402 9.14068 4.91593 5.29491 8.1971 9.91024 numMergedOcc 0
3 mol 108 unq 1 iso 0 dist 5.52402 9.14068 4.91593 9.40297 7.84262 5.60118 numMergedOcc 0
4 mol 108 unq 2 iso 0 dist 7.57593 9.14068 6.23415 5.29491 10.3428 9.91024 numMergedOcc 0
5 mol 108 unq 3 iso 0 dist 7.57593 9.14068 6.23415 9.40297 9.29208 5.60118 numMergedOcc 0
6 mol 108 unq 4 iso 0 dist 6.79804 7.90433 4.91593 5.49549 8.1971 9.91024 numMergedOcc 0
7 mol 108 unq 5 iso 0 dist 6.79804 7.90433 4.91593 5.53105 7.84262 5.60118 numMergedOcc 0
8 mol 119 unq 0 iso 0 dist 9.44788 9.10803 6.14609 10.872 9.22776 6.39945 numMergedOcc 0
9 mol 119 unq 1 iso 0 dist 9.44788 9.10803 6.14609 12.1048 13.0132 7.14258 numMergedOcc 0
10 mol 128 unq 0 iso 0 dist 5.4772 9.67042 8.1634 11.5809 13.5287 7.9883 numMergedOcc 0
11 mol 128 unq 1 iso 0 dist 7.84607 9.01072 8.1634 8.56151 13.5287 7.9883 numMergedOcc 0
12 mol 141 unq 0 iso 0 dist 6.32669 5.56446 7.13673 5.05068 7.83578 7.11411 numMergedOcc 0
13 mol 186 unq 0 iso 0 dist 9.71223 9.18289 5.32701 9.45075 8.43722 7.7734 numMergedOcc 0
14 mol 192 unq 0 iso 0 dist 7.252 7.93715 12.8252 12.2163 18.2113 9.19818 numMergedOcc 0
15 mol 207 unq 0 iso 0 dist 9.05505 6.50724 5.08264 9.63971 10.6808 6.06003 numMergedOcc 0
16 mol 235 unq 0 iso 0 dist 8.88613 5.39924 7.19464 4.26151 9.96454 5.38046 numMergedOcc 0
17 mol 239 unq 0 iso 0 dist 8.68803 7.96523 3.80345 9.67509 9.05655 5.68578 numMergedOcc 0
18 mol 239 unq 1 iso 0 dist 8.68803 7.96523 3.80345 13.9346 10.952 9.50933 numMergedOcc 0
19 mol 256 unq 0 iso 0 dist 9.71499 7.23526 4.85236 8.22925 13.1681 8.89351 numMergedOcc 0
20 mol 273 unq 0 iso 0 dist 9.52454 8.89714 9.32473 12.565 12.2985 5.63226 numMergedOcc 0
21 mol 283 unq 0 iso 0 dist 7.90132 8.4275 12.1132 10.147 17.6169 9.60873 numMergedOcc 0
22 mol 283 unq 1 iso 0 dist 8.80418 7.81241 10.5903 12.3631 17.6169 9.4181 numMergedOcc 0
23 mol 283 unq 2 iso 0 dist 8.80418 7.81241 10.5903 5.49773 11.1771 5.05882 numMergedOcc 0
