0 mol 25 unq 0 iso 0 dist 7.0928 6.04822 5.03027 6.32132 5.04899 7.52933 12.8208 5.8503 10.0172 8.6396 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 7.0928 7.72717 8.17061 6.32132 5.04899 8.23761 12.8208 5.8503 12.2787 8.6396 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 9.61029 7.54282 7.11305 14.3476 8.34347 14.8317 14.2961 5.3315 12.2008 6.88695 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.16827 5.19462 5.07458 12.092 6.20293 10.0168 19.9966 11.8286 16.7913 8.38387 numMergedOcc 0
4 mol 59 unq 0 iso 0 dist 8.97292 8.58849 11.3575 7.2878 6.85766 14.0887 9.76644 5.34079 10.8351 8.05508 numMergedOcc 0
5 mol 59 unq 1 iso 0 dist 8.97292 5.73075 13.6023 7.2878 6.85766 12.9907 9.76644 5.34079 13.7769 8.05508 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 6.05043 9.05612 3.94537 6.40193 7.27724 9.3948 8.54807 5.33325 8.55456 9.65047 numMergedOcc 0
7 mol 119 unq 0 iso 0 dist 8.32004 9.9292 6.20019 6.92096 9.87172 6.99446 13.9077 12.1192 5.92411 8.44385 numMergedOcc 0
8 mol 129 unq 0 iso 0 dist 8.14071 7.11486 6.16616 13.1328 5.83384 11.8464 17.5691 10.0961 15.1569 6.38163 numMergedOcc 0
9 mol 214 unq 0 iso 0 dist 8.3035 8.9694 8.48942 6.23589 8.82096 13.7978 6.99667 4.55245 11.5597 4.84709 numMergedOcc 0
10 mol 214 unq 1 iso 0 dist 9.01896 8.70011 8.52282 7.3913 8.82096 13.9627 6.22499 4.55245 9.75492 4.84709 numMergedOcc 0
11 mol 238 unq 0 iso 0 dist 7.80166 9.97859 10.4706 6.77788 5.72887 8.923 12.7061 12.521 3.72761 9.94315 numMergedOcc 0
12 mol 238 unq 1 iso 0 dist 7.80166 9.97859 10.4706 6.77788 5.72887 8.923 12.3224 9.18011 5.17342 8.59074 numMergedOcc 0
13 mol 238 unq 2 iso 0 dist 7.80166 9.97859 10.4706 6.77788 5.72887 8.923 11.0982 4.7157 9.65378 6.2365 numMergedOcc 0
14 mol 259 unq 0 iso 0 dist 6.49599 7.8428 9.99423 14.1932 8.13497 17.1878 16.214 10.4985 20.1883 5.90645 numMergedOcc 0
