0 mol 4 unq 0 iso 0 dist 9.61247 5.51567 5.46803 6.1326 9.25752 8.68164 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 8.53436 8.09253 9.24342 11.5593 15.7244 6.77807 numMergedOcc 0
2 mol 76 unq 0 iso 0 dist 7.71596 9.78762 8.66335 7.24635 10.0184 5.45099 numMergedOcc 0
3 mol 76 unq 1 iso 0 dist 7.71596 9.78762 8.66335 8.05782 12.6631 8.44765 numMergedOcc 0
4 mol 76 unq 2 iso 0 dist 7.71596 9.78762 8.66335 12.4827 15.8438 9.06643 numMergedOcc 0
5 mol 78 unq 0 iso 0 dist 9.68277 6.90069 4.83459 5.80317 13.3992 9.38837 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 7.26463 6.88175 4.80926 9.26859 8.53215 4.55071 numMergedOcc 0
7 mol 142 unq 0 iso 0 dist 9.5355 5.90339 9.23267 5.19808 5.79144 5.42679 numMergedOcc 0
8 mol 184 unq 0 iso 0 dist 5.13722 9.07247 10.6375 6.53883 8.7823 5.23187 numMergedOcc 0
9 mol 186 unq 0 iso 0 dist 8.40343 7.12029 8.06464 7.93285 10.5212 9.17458 numMergedOcc 0
10 mol 186 unq 1 iso 0 dist 8.40343 7.12029 8.06464 8.70013 10.3861 7.36794 numMergedOcc 0
11 mol 186 unq 2 iso 0 dist 8.40343 8.56602 5.21837 7.93285 10.5212 6.94594 numMergedOcc 0
12 mol 186 unq 3 iso 0 dist 8.40343 8.56602 5.21837 8.70013 10.3861 5.81881 numMergedOcc 0
13 mol 193 unq 0 iso 0 dist 9.16852 8.28942 9.98298 3.72752 11.7397 6.94187 numMergedOcc 0
14 mol 205 unq 0 iso 0 dist 8.21112 7.18098 11.3947 6.20494 9.88692 7.88986 numMergedOcc 0
15 mol 205 unq 1 iso 0 dist 8.21112 7.18098 11.3947 8.39697 13.464 7.4185 numMergedOcc 0
16 mol 224 unq 0 iso 0 dist 4.99301 6.57713 9.89658 5.8264 6.04509 7.98132 numMergedOcc 0
17 mol 224 unq 1 iso 0 dist 4.99301 6.57713 9.89658 9.59133 10.8447 7.99036 numMergedOcc 0
18 mol 224 unq 2 iso 0 dist 6.36813 6.57713 11.9701 5.8264 11.1365 7.98132 numMergedOcc 0
19 mol 224 unq 3 iso 0 dist 6.36813 6.57713 11.9701 9.59133 15.6565 7.99036 numMergedOcc 0
20 mol 251 unq 0 iso 0 dist 8.84041 7.95984 6.02024 15.3453 11.9202 7.72528 numMergedOcc 0
21 mol 260 unq 0 iso 0 dist 9.05149 8.29663 7.50166 8.05498 13.3487 7.49606 numMergedOcc 0
22 mol 270 unq 0 iso 0 dist 7.65449 8.75041 13.3415 10.9361 18.3421 9.67647 numMergedOcc 0
23 mol 279 unq 0 iso 0 dist 8.87355 9.44618 5.10922 11.096 13.0614 8.62266 numMergedOcc 0
