0 mol 24 unq 0 iso 0 dist 8.94703 8.95357 8.45916 13.7241 9.03541 17.1139 numMergedOcc 0
1 mol 48 unq 0 iso 0 dist 5.41774 8.12928 8.63743 7.34462 7.95815 13.0605 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 6.63973 15.1383 9.78762 15.9053 9.3711 9.553 numMergedOcc 0
3 mol 89 unq 0 iso 0 dist 7.55644 4.78712 5.10735 4.93796 8.68698 8.2865 numMergedOcc 0
4 mol 130 unq 0 iso 0 dist 5.82945 5.76927 9.58844 6.44931 6.98077 5.74226 numMergedOcc 0
5 mol 186 unq 0 iso 0 dist 9.18289 13.4102 8.41456 9.45075 7.7734 4.98693 numMergedOcc 0
6 mol 192 unq 0 iso 0 dist 8.8637 10.161 9.62225 12.9121 7.578 7.4314 numMergedOcc 0
7 mol 192 unq 1 iso 0 dist 8.8637 10.161 9.62225 6.70053 9.24926 9.81428 numMergedOcc 0
8 mol 197 unq 0 iso 0 dist 6.90791 5.78569 6.66653 9.04527 9.68213 3.94255 numMergedOcc 0
9 mol 205 unq 0 iso 0 dist 8.69512 7.43264 7.84418 14.2869 8.71347 9.60726 numMergedOcc 0
10 mol 205 unq 1 iso 0 dist 8.69512 12.1402 6.92823 14.2869 8.71347 5.18043 numMergedOcc 0
11 mol 207 unq 0 iso 0 dist 6.50724 4.67499 9.93721 9.63971 6.06003 11.5669 numMergedOcc 0
12 mol 207 unq 1 iso 0 dist 6.50724 6.23526 6.29106 9.63971 6.06003 4.85991 numMergedOcc 0
13 mol 238 unq 0 iso 0 dist 6.96382 5.12308 5.41453 15.2081 8.28643 12.2489 numMergedOcc 0
14 mol 239 unq 0 iso 0 dist 7.96523 4.53635 6.0567 9.67509 5.68578 5.58332 numMergedOcc 0
15 mol 239 unq 1 iso 0 dist 7.96523 4.53635 6.0567 13.9346 9.50933 14.0017 numMergedOcc 0
16 mol 247 unq 0 iso 0 dist 9.01651 8.53302 5.52484 9.83927 7.95874 11.346 numMergedOcc 0
17 mol 247 unq 1 iso 0 dist 8.83903 9.26852 5.52484 5.40081 7.95874 11.346 numMergedOcc 0
18 mol 260 unq 0 iso 0 dist 7.27503 6.67281 8.01717 10.5646 7.88296 5.67835 numMergedOcc 0
19 mol 283 unq 0 iso 0 dist 8.4275 7.50871 8.39635 10.147 9.60873 5.2842 numMergedOcc 0
20 mol 285 unq 0 iso 0 dist 8.27917 10.8233 9.26793 14.9595 9.30058 18.1671 numMergedOcc 0
21 mol 285 unq 1 iso 0 dist 8.27917 10.8233 9.26793 11.1486 6.5354 14.2829 numMergedOcc 0
