0 mol 11 unq 0 iso 0 dist 4.61088 6.54358 4.10106 6.86684 5.96346 6.859 12.2274 8.05213 9.58844 8.73067 numMergedOcc 0
1 mol 25 unq 0 iso 0 dist 7.31767 7.6114 6.10919 5.68392 9.79094 6.29797 10.7177 6.54985 6.25564 9.62401 numMergedOcc 0
2 mol 25 unq 1 iso 0 dist 6.03987 7.6114 5.86705 5.68392 6.85556 6.29797 10.7177 5.09159 6.25564 9.62401 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 6.62496 9.22598 9.87158 9.95364 8.80614 9.01564 16.3613 13.9007 10.7557 7.6481 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 6.62496 9.22598 9.87158 9.95364 8.80614 9.01564 11.5023 6.47744 14.6599 9.11258 numMergedOcc 0
5 mol 58 unq 2 iso 0 dist 6.35756 8.96727 9.87158 5.49591 8.80614 9.01564 12.7237 13.9007 10.7557 7.6481 numMergedOcc 0
6 mol 58 unq 3 iso 0 dist 6.35756 8.96727 9.87158 5.49591 8.80614 9.01564 8.89374 6.47744 14.6599 9.11258 numMergedOcc 0
7 mol 58 unq 4 iso 0 dist 6.35756 8.01308 5.86526 5.49591 8.80614 7.11065 12.7237 13.9007 9.1083 7.6481 numMergedOcc 0
8 mol 58 unq 5 iso 0 dist 6.35756 8.01308 5.86526 5.49591 8.80614 7.11065 8.89374 6.47744 9.47022 9.11258 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 9.38498 9.73086 17.4121 5.11416 13.8696 6.14542 8.70133 13.4082 6.15714 7.10439 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 9.96396 9.73086 5.70116 5.11416 9.24757 6.14542 8.70133 7.41074 6.15714 7.10439 numMergedOcc 0
11 mol 73 unq 2 iso 0 dist 6.19304 8.68662 6.20232 6.56633 9.24757 8.96616 4.65521 7.41074 6.10063 7.10439 numMergedOcc 0
12 mol 73 unq 3 iso 0 dist 6.19304 7.4369 5.70116 6.56633 9.24757 6.14542 4.65521 7.41074 6.15714 7.10439 numMergedOcc 0
13 mol 73 unq 4 iso 0 dist 9.75218 9.73086 14.844 5.11416 13.0145 6.14542 8.70133 15.9882 6.15714 7.10439 numMergedOcc 0
14 mol 100 unq 0 iso 0 dist 8.87449 9.90751 9.72773 6.12107 12.0685 7.81446 10.6643 12.9174 4.22932 6.0652 numMergedOcc 0
15 mol 100 unq 1 iso 0 dist 8.87449 9.21662 9.39125 6.12107 12.0685 6.55173 10.6643 12.9174 6.13211 6.0652 numMergedOcc 0
16 mol 100 unq 2 iso 0 dist 9.60661 8.91882 4.03277 6.71012 9.1361 6.55173 10.5193 10.1499 6.13211 6.0652 numMergedOcc 0
17 mol 100 unq 3 iso 0 dist 6.65086 8.91882 6.23008 6.71012 9.5074 6.55173 10.5193 10.1589 6.13211 6.0652 numMergedOcc 0
18 mol 134 unq 0 iso 0 dist 8.94367 7.21868 8.06642 4.57832 6.23142 9.0176 11.2292 5.3585 9.48887 8.55616 numMergedOcc 0
19 mol 134 unq 1 iso 0 dist 8.94367 7.21868 8.06642 4.57832 6.23142 9.0176 8.79571 5.41704 5.67107 8.73604 numMergedOcc 0
20 mol 134 unq 2 iso 0 dist 6.37586 7.93372 8.06642 5.29786 6.23142 9.0176 10.9613 5.3585 9.48887 8.55616 numMergedOcc 0
21 mol 134 unq 3 iso 0 dist 6.37586 7.93372 8.06642 5.29786 6.23142 9.0176 5.42582 5.41704 5.67107 8.73604 numMergedOcc 0
22 mol 134 unq 4 iso 0 dist 9.86662 7.21868 4.00092 4.57832 9.94764 9.0176 11.2292 6.74887 9.48887 8.55616 numMergedOcc 0
23 mol 134 unq 5 iso 0 dist 9.86662 7.21868 4.00092 4.57832 9.94764 9.0176 8.79571 6.17103 5.67107 8.73604 numMergedOcc 0
24 mol 134 unq 6 iso 0 dist 9.71307 7.93372 4.00092 5.29786 9.94764 9.0176 10.9613 6.74887 9.48887 8.55616 numMergedOcc 0
25 mol 134 unq 7 iso 0 dist 9.71307 7.93372 4.00092 5.29786 9.94764 9.0176 5.42582 6.17103 5.67107 8.73604 numMergedOcc 0
26 mol 143 unq 0 iso 0 dist 5.99315 5.37047 4.78563 6.48978 7.78652 5.06564 9.60643 10.0989 5.43382 6.97487 numMergedOcc 0
27 mol 143 unq 1 iso 0 dist 5.99315 5.37047 4.78563 6.48978 7.78652 5.06564 9.27292 6.01455 4.38322 6.46089 numMergedOcc 0
28 mol 155 unq 0 iso 0 dist 7.46303 8.97626 9.16779 5.50031 12.2416 9.16358 7.51198 5.86939 4.48516 9.80845 numMergedOcc 0
29 mol 155 unq 1 iso 0 dist 7.46303 8.97626 9.16779 6.89781 10.9606 9.24038 9.14392 6.3845 12.0485 9.0529 numMergedOcc 0
30 mol 155 unq 2 iso 0 dist 7.46303 8.97626 9.16779 6.89781 10.9606 9.24038 7.51198 5.86939 4.48516 7.55196 numMergedOcc 0
31 mol 155 unq 3 iso 0 dist 6.43582 8.97626 4.91785 5.50031 7.92304 9.16358 7.51198 6.34186 4.48516 9.80845 numMergedOcc 0
32 mol 155 unq 4 iso 0 dist 6.43582 8.97626 4.91785 6.89781 10.3161 9.24038 9.14392 12.1814 12.0485 9.0529 numMergedOcc 0
33 mol 155 unq 5 iso 0 dist 6.43582 8.97626 4.91785 6.89781 10.3161 9.24038 7.51198 6.34186 4.48516 7.55196 numMergedOcc 0
34 mol 181 unq 0 iso 0 dist 7.81386 6.64173 6.8757 5.63555 10.4943 8.12266 7.98142 9.53462 4.48306 5.97685 numMergedOcc 0
35 mol 181 unq 1 iso 0 dist 7.81386 6.64173 6.8757 5.63555 10.4943 8.12266 7.37327 11.1462 4.88823 8.9289 numMergedOcc 0
36 mol 181 unq 2 iso 0 dist 7.81386 9.55105 5.83796 5.63555 10.4943 9.43306 7.98142 9.53462 10.2172 5.97685 numMergedOcc 0
37 mol 181 unq 3 iso 0 dist 7.81386 9.55105 5.83796 5.63555 10.4943 9.43306 7.37327 11.1462 14.2334 8.9289 numMergedOcc 0
38 mol 181 unq 4 iso 0 dist 7.63312 6.64173 10.6474 5.63555 5.9176 8.12266 7.98142 9.60512 4.48306 5.97685 numMergedOcc 0
39 mol 181 unq 5 iso 0 dist 7.63312 6.64173 10.6474 5.63555 5.9176 8.12266 7.37327 13.3389 4.88823 8.9289 numMergedOcc 0
40 mol 181 unq 6 iso 0 dist 7.63312 9.55105 5.12833 5.63555 5.9176 9.43306 7.98142 9.60512 10.2172 5.97685 numMergedOcc 0
41 mol 181 unq 7 iso 0 dist 7.63312 9.55105 5.12833 5.63555 5.9176 9.43306 7.37327 13.3389 14.2334 8.9289 numMergedOcc 0
42 mol 227 unq 0 iso 0 dist 7.22101 5.23634 5.0317 10.9607 5.41321 8.91971 8.17891 6.43754 4.09934 7.57454 numMergedOcc 0
43 mol 227 unq 1 iso 0 dist 8.65997 6.91318 5.0317 9.72615 5.41321 8.91971 6.95902 6.43754 4.09934 7.57454 numMergedOcc 0
44 mol 227 unq 2 iso 0 dist 7.09863 5.23634 5.83175 10.9607 9.74265 8.91971 8.17891 9.13836 4.09934 7.57454 numMergedOcc 0
45 mol 232 unq 0 iso 0 dist 8.27212 6.71524 5.10213 4.9377 9.40808 9.9183 11.4727 13.5597 14.5281 7.17337 numMergedOcc 0
46 mol 234 unq 0 iso 0 dist 9.45496 7.81215 12.4252 10.0059 17.6227 7.77911 9.5707 15.9563 11.8229 7.43663 numMergedOcc 0
47 mol 234 unq 1 iso 0 dist 9.45496 7.81215 12.4252 10.0059 17.6227 7.77911 10.475 13.3898 6.45373 7.94068 numMergedOcc 0
48 mol 234 unq 2 iso 0 dist 6.7625 7.81215 5.75498 10.0059 12.6238 7.77911 9.5707 14.4106 11.8229 7.43663 numMergedOcc 0
49 mol 234 unq 3 iso 0 dist 6.7625 7.81215 5.75498 10.0059 12.6238 7.77911 10.475 10.0607 6.45373 7.94068 numMergedOcc 0
50 mol 273 unq 0 iso 0 dist 9.01049 9.59325 12.2939 4.60101 11.6152 6.35532 12.7608 19.6293 10.9311 8.68913 numMergedOcc 0
