0 mol 11 unq 0 iso 0 dist 5.96346 8.05213 8.73067 10.7734 7.98326 7.5901 4.10106 6.859 9.58844 9.74251 numMergedOcc 0
1 mol 11 unq 1 iso 0 dist 5.96346 8.05213 8.73067 9.62262 7.46578 12.5553 4.10106 6.859 9.58844 6.56765 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 8.40416 6.74265 7.02548 4.64838 9.95212 5.90856 10.4416 8.54034 4.01494 9.79414 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 7.75618 5.5841 7.02548 4.97119 9.95212 5.90856 8.7083 8.54034 4.01494 9.79414 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 6.46104 11.0099 7.3022 7.23703 6.93197 6.78223 5.56139 6.07276 10.267 10.1622 numMergedOcc 0
5 mol 26 unq 1 iso 0 dist 7.36856 4.74747 7.3022 5.81765 6.93197 6.78223 7.73394 6.07276 10.267 10.1622 numMergedOcc 0
6 mol 73 unq 0 iso 0 dist 9.24757 7.41074 7.10439 6.29906 8.87464 9.79695 6.20232 8.96616 6.10063 5.29727 numMergedOcc 0
7 mol 73 unq 1 iso 0 dist 9.24757 7.41074 7.10439 6.29906 8.87464 9.79695 5.70116 6.14542 6.15714 3.85385 numMergedOcc 0
8 mol 85 unq 0 iso 0 dist 9.82915 15.8792 6.05495 10.4987 9.66222 13.3263 11.9064 5.05893 7.2898 11.0952 numMergedOcc 0
9 mol 85 unq 1 iso 0 dist 9.82915 15.8792 6.05495 10.4987 9.66222 13.3263 14.7521 5.71866 4.13305 12.5181 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 7.69991 6.69989 8.55616 7.41674 6.40575 10.6595 12.847 9.0176 9.48887 15.0575 numMergedOcc 0
11 mol 134 unq 1 iso 0 dist 7.69991 10.1448 8.73604 7.41674 6.40575 14.1488 12.847 9.0176 5.67107 15.0575 numMergedOcc 0
12 mol 134 unq 2 iso 0 dist 6.23142 5.3585 8.55616 9.87376 6.40575 10.6595 8.06642 9.0176 9.48887 15.0575 numMergedOcc 0
13 mol 134 unq 3 iso 0 dist 6.23142 5.41704 8.73604 9.87376 6.40575 14.1488 8.06642 9.0176 5.67107 15.0575 numMergedOcc 0
14 mol 134 unq 4 iso 0 dist 9.94764 6.74887 8.55616 14.9876 6.40575 10.6595 4.00092 9.0176 9.48887 15.0575 numMergedOcc 0
15 mol 134 unq 5 iso 0 dist 9.94764 6.17103 8.73604 14.9876 6.40575 14.1488 4.00092 9.0176 5.67107 15.0575 numMergedOcc 0
16 mol 141 unq 0 iso 0 dist 8.10291 10.5489 4.25566 14.7684 9.83945 7.64948 4.32342 7.42144 10.9801 16.2294 numMergedOcc 0
17 mol 141 unq 1 iso 0 dist 8.10291 10.5489 4.25566 14.7684 9.83945 7.64948 7.17845 6.27658 10.0279 15.9806 numMergedOcc 0
18 mol 141 unq 2 iso 0 dist 8.10291 6.71391 6.63171 14.7684 9.83945 14.2837 4.32342 7.42144 6.88786 16.2294 numMergedOcc 0
19 mol 141 unq 3 iso 0 dist 8.10291 6.71391 6.63171 14.7684 9.83945 14.2837 7.17845 6.27658 6.8633 15.9806 numMergedOcc 0
20 mol 141 unq 4 iso 0 dist 8.10291 6.6258 7.67273 14.7684 9.83945 10.6379 4.32342 7.42144 9.63622 16.2294 numMergedOcc 0
21 mol 141 unq 5 iso 0 dist 8.10291 6.6258 7.67273 14.7684 9.83945 10.6379 7.17845 6.27658 10.8428 15.9806 numMergedOcc 0
22 mol 181 unq 0 iso 0 dist 6.59025 7.07409 6.32777 7.81713 8.86197 7.23063 6.28125 9.88897 5.82396 5.3698 numMergedOcc 0
23 mol 181 unq 1 iso 0 dist 6.59025 7.07409 6.32777 7.16549 5.94379 5.42554 6.28125 9.88897 5.82396 9.56782 numMergedOcc 0
24 mol 181 unq 2 iso 0 dist 5.9176 9.60512 5.97685 6.29863 7.22883 11.2039 10.6474 8.12266 4.48306 14.2282 numMergedOcc 0
25 mol 181 unq 3 iso 0 dist 5.9176 9.60512 5.97685 6.29863 7.22883 11.2039 5.12833 9.43306 10.2172 10.273 numMergedOcc 0
26 mol 181 unq 4 iso 0 dist 5.9176 9.60512 5.97685 6.29863 7.22883 11.2039 4.61184 8.59681 10.9122 5.14966 numMergedOcc 0
27 mol 181 unq 5 iso 0 dist 5.9176 13.3389 8.9289 6.29863 7.22883 15.9559 10.6474 8.12266 4.88823 14.2282 numMergedOcc 0
28 mol 181 unq 6 iso 0 dist 5.9176 13.3389 8.9289 6.29863 7.22883 15.9559 5.12833 9.43306 14.2334 10.273 numMergedOcc 0
29 mol 181 unq 7 iso 0 dist 5.9176 13.3389 8.9289 6.29863 7.22883 15.9559 4.61184 8.59681 16.1796 5.14966 numMergedOcc 0
30 mol 181 unq 8 iso 0 dist 5.94469 6.7991 7.05653 9.69409 9.92471 9.67649 5.42158 8.06308 5.82984 5.42414 numMergedOcc 0
31 mol 194 unq 0 iso 0 dist 6.72379 5.38925 9.3402 7.11753 6.38324 5.63279 4.66791 9.00322 6.72001 7.41775 numMergedOcc 0
32 mol 232 unq 0 iso 0 dist 8.50102 8.78722 7.17337 6.2188 9.78181 5.12599 9.74344 9.9183 14.5281 14.876 numMergedOcc 0
33 mol 232 unq 1 iso 0 dist 8.50102 8.78722 7.17337 12.3508 9.8664 16.1253 9.74344 9.9183 14.5281 11.2243 numMergedOcc 0
34 mol 232 unq 2 iso 0 dist 9.40808 13.5597 7.17337 12.5452 9.78181 5.12599 5.10213 9.9183 14.5281 14.876 numMergedOcc 0
35 mol 232 unq 3 iso 0 dist 9.40808 13.5597 7.17337 8.80479 9.8664 16.1253 5.10213 9.9183 14.5281 11.2243 numMergedOcc 0
36 mol 273 unq 0 iso 0 dist 8.83865 4.89568 8.68913 12.0136 7.16346 13.9948 4.24707 7.85836 8.0478 8.43367 numMergedOcc 0
37 mol 273 unq 1 iso 0 dist 8.83865 4.89568 8.68913 12.0136 7.16346 13.9948 8.56043 6.35532 10.9311 3.78984 numMergedOcc 0
38 mol 273 unq 2 iso 0 dist 9.18157 5.14347 8.68913 12.1851 7.16346 13.9948 6.65672 7.85836 8.0478 8.43367 numMergedOcc 0
39 mol 273 unq 3 iso 0 dist 9.18157 5.14347 8.68913 12.1851 7.16346 13.9948 8.81454 6.35532 10.9311 3.78984 numMergedOcc 0
