0 mol 68 unq 0 iso 0 dist 9.74289 3.95228 7.51075 5.37144 7.39665 6.56256 8.56621 7.1369 6.88786 6.37273 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 7.28058 7.70943 8.06168 15.8189 8.72682 13.9003 5.60664 4.49951 9.87177 11.748 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 7.28058 7.70943 8.06168 9.77994 6.45841 8.88868 5.60664 4.49951 9.87177 10.0791 numMergedOcc 0
3 mol 73 unq 2 iso 0 dist 7.28058 7.70943 8.06168 10.8484 5.61588 10.8798 5.60664 4.49951 9.87177 9.37392 numMergedOcc 0
4 mol 73 unq 3 iso 0 dist 7.28058 7.70943 8.06168 14.7963 7.83244 13.7267 5.60664 4.49951 9.87177 11.6626 numMergedOcc 0
5 mol 73 unq 4 iso 0 dist 7.28058 3.98918 8.67532 15.8189 8.72682 17.2466 5.60664 4.49951 6.70925 11.748 numMergedOcc 0
6 mol 73 unq 5 iso 0 dist 7.28058 3.98918 8.67532 9.77994 6.45841 10.2047 5.60664 4.49951 6.70925 10.0791 numMergedOcc 0
7 mol 73 unq 6 iso 0 dist 7.28058 3.98918 8.67532 10.8484 5.61588 10.8441 5.60664 4.49951 6.70925 9.37392 numMergedOcc 0
8 mol 73 unq 7 iso 0 dist 7.28058 3.98918 8.67532 14.7963 7.83244 15.2203 5.60664 4.49951 6.70925 11.6626 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 5.17291 3.98395 7.47794 8.27493 9.13322 12.1618 8.99189 5.31439 9.06225 14.1873 numMergedOcc 0
10 mol 76 unq 1 iso 0 dist 8.81569 10.3277 7.47794 12.0737 9.13322 12.1618 8.94097 5.31439 9.06225 14.1873 numMergedOcc 0
11 mol 133 unq 0 iso 0 dist 7.85025 13.039 5.82404 13.4842 8.77023 11.5628 13.8387 7.96098 6.23615 10.271 numMergedOcc 0
12 mol 197 unq 0 iso 0 dist 7.18765 14.6497 8.3337 4.26432 9.10817 17.2264 18.1223 11.713 8.47576 20.1839 numMergedOcc 0
13 mol 197 unq 1 iso 0 dist 7.18765 14.6497 8.3337 4.26432 9.10817 17.2264 15.8386 8.69245 5.79753 17.3813 numMergedOcc 0
14 mol 197 unq 2 iso 0 dist 7.18765 14.6497 8.3337 14.0652 9.73548 5.5875 18.1223 11.713 8.47576 14.0008 numMergedOcc 0
15 mol 197 unq 3 iso 0 dist 7.18765 14.6497 8.3337 14.0652 9.73548 5.5875 15.8386 8.69245 5.79753 10.8958 numMergedOcc 0
16 mol 218 unq 0 iso 0 dist 9.95084 15.8157 7.73315 13.8104 7.33709 3.5359 21.1668 12.0573 6.2441 8.38813 numMergedOcc 0
17 mol 234 unq 0 iso 0 dist 7.17987 14.3029 7.86368 12.4759 7.81215 9.8663 11.1153 6.16697 9.36753 12.4723 numMergedOcc 0
18 mol 257 unq 0 iso 0 dist 6.44188 9.11516 9.83721 6.16483 7.81897 14.007 16.1475 13.2456 8.9297 19.0929 numMergedOcc 0
19 mol 257 unq 1 iso 0 dist 5.13633 12.611 9.83721 5.48725 7.81897 14.007 17.978 13.2456 8.9297 19.0929 numMergedOcc 0
20 mol 264 unq 0 iso 0 dist 6.66602 9.34577 6.83408 12.6107 9.58916 3.63202 5.11475 5.11257 9.8799 13.3355 numMergedOcc 0
21 mol 292 unq 0 iso 0 dist 7.29148 11.1098 5.75596 14.9639 9.9182 6.65781 19.8117 13.9754 8.92332 7.02679 numMergedOcc 0
22 mol 292 unq 1 iso 0 dist 7.29148 11.1098 5.75596 13.1177 8.9221 4.00064 19.8117 13.9754 8.92332 9.08889 numMergedOcc 0
