0 mol 7 unq 0 iso 0 dist 7.10621 8.72114 13.8829 7.12508 6.1206 11.2901 10.515 9.36807 9.97624 7.92429 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.10621 8.72114 13.8829 11.143 7.67927 16.0449 10.515 9.36807 9.97624 11.2233 numMergedOcc 0
2 mol 9 unq 0 iso 0 dist 8.57077 9.62394 9.5997 8.69454 8.55451 14.126 5.60154 8.47421 9.57198 5.66192 numMergedOcc 0
3 mol 9 unq 1 iso 0 dist 8.57077 9.62394 9.5997 5.84314 5.8245 10.9352 5.60154 8.47421 9.57198 3.91075 numMergedOcc 0
4 mol 11 unq 0 iso 0 dist 4.61088 5.96346 6.86684 4.10106 6.54358 6.859 8.05213 12.2274 8.73067 9.58844 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 5.04899 9.01548 13.9331 6.47509 7.05196 12.506 4.70708 9.43699 6.63839 8.44757 numMergedOcc 0
6 mol 25 unq 1 iso 0 dist 6.03987 6.85556 5.68392 5.86705 7.6114 6.29797 5.09159 10.7177 9.62401 6.25564 numMergedOcc 0
7 mol 58 unq 0 iso 0 dist 6.81627 7.21955 7.09066 5.61579 5.38524 10.4354 6.75888 10.335 8.71468 11.0945 numMergedOcc 0
8 mol 58 unq 1 iso 0 dist 7.32874 7.21955 7.12541 5.61579 8.69057 10.4354 6.75888 6.40841 8.71468 11.0945 numMergedOcc 0
9 mol 58 unq 2 iso 0 dist 6.62496 8.80614 9.95364 9.87158 9.22598 9.01564 13.9007 16.3613 7.6481 10.7557 numMergedOcc 0
10 mol 58 unq 3 iso 0 dist 6.62496 8.80614 9.95364 9.87158 9.22598 9.01564 6.47744 11.5023 9.11258 14.6599 numMergedOcc 0
11 mol 58 unq 4 iso 0 dist 6.35756 8.80614 5.49591 9.87158 8.96727 9.01564 13.9007 12.7237 7.6481 10.7557 numMergedOcc 0
12 mol 58 unq 5 iso 0 dist 6.35756 8.80614 5.49591 9.87158 8.96727 9.01564 6.47744 8.89374 9.11258 14.6599 numMergedOcc 0
13 mol 58 unq 6 iso 0 dist 6.35756 8.80614 5.49591 5.86526 8.01308 7.11065 13.9007 12.7237 7.6481 9.1083 numMergedOcc 0
14 mol 58 unq 7 iso 0 dist 6.35756 8.80614 5.49591 5.86526 8.01308 7.11065 6.47744 8.89374 9.11258 9.47022 numMergedOcc 0
15 mol 64 unq 0 iso 0 dist 9.67592 9.97159 6.21578 5.16015 9.86334 12.5444 5.3948 8.68586 9.32552 8.84224 numMergedOcc 0
16 mol 73 unq 0 iso 0 dist 9.96396 9.24757 5.11416 5.70116 9.73086 6.14542 7.41074 8.70133 7.10439 6.15714 numMergedOcc 0
17 mol 73 unq 1 iso 0 dist 6.19304 9.24757 6.56633 6.20232 8.68662 8.96616 7.41074 4.65521 7.10439 6.10063 numMergedOcc 0
18 mol 73 unq 2 iso 0 dist 6.19304 9.24757 6.56633 5.70116 7.4369 6.14542 7.41074 4.65521 7.10439 6.15714 numMergedOcc 0
19 mol 73 unq 3 iso 0 dist 8.70481 9.24757 15.3808 11.2069 5.5087 14.6027 7.41074 15.9587 7.10439 17.2861 numMergedOcc 0
20 mol 73 unq 4 iso 0 dist 8.70481 9.24757 15.3808 10.6713 6.08682 13.8591 7.41074 15.9587 7.10439 16.8311 numMergedOcc 0
21 mol 92 unq 0 iso 0 dist 7.4729 6.95572 9.50382 4.46885 8.3773 9.92987 9.32974 10.6071 6.72712 9.09983 numMergedOcc 0
22 mol 92 unq 1 iso 0 dist 7.4729 6.95572 9.50382 4.46885 8.3773 9.92987 6.99832 5.81965 5.39745 7.94489 numMergedOcc 0
23 mol 134 unq 0 iso 0 dist 8.94367 6.23142 4.57832 8.06642 7.21868 9.0176 5.3585 11.2292 8.55616 9.48887 numMergedOcc 0
24 mol 134 unq 1 iso 0 dist 8.94367 6.23142 4.57832 8.06642 7.21868 9.0176 5.41704 8.79571 8.73604 5.67107 numMergedOcc 0
25 mol 134 unq 2 iso 0 dist 6.37586 6.23142 5.29786 6.95573 9.33924 12.2587 5.3585 10.9613 8.55616 11.1029 numMergedOcc 0
26 mol 134 unq 3 iso 0 dist 6.37586 6.23142 5.29786 6.95573 9.33924 12.2587 5.41704 5.42582 8.73604 6.0991 numMergedOcc 0
27 mol 134 unq 4 iso 0 dist 6.37586 6.23142 5.29786 8.06642 7.93372 9.0176 5.3585 10.9613 8.55616 9.48887 numMergedOcc 0
28 mol 134 unq 5 iso 0 dist 6.37586 6.23142 5.29786 8.06642 7.93372 9.0176 5.41704 5.42582 8.73604 5.67107 numMergedOcc 0
29 mol 134 unq 6 iso 0 dist 9.86662 9.94764 4.57832 4.00092 7.21868 9.0176 6.74887 11.2292 8.55616 9.48887 numMergedOcc 0
30 mol 134 unq 7 iso 0 dist 9.86662 9.94764 4.57832 4.00092 7.21868 9.0176 6.17103 8.79571 8.73604 5.67107 numMergedOcc 0
31 mol 134 unq 8 iso 0 dist 9.71307 9.94764 5.29786 10.2026 9.33924 12.2587 6.74887 10.9613 8.55616 11.1029 numMergedOcc 0
32 mol 134 unq 9 iso 0 dist 9.71307 9.94764 5.29786 10.2026 9.33924 12.2587 6.17103 5.42582 8.73604 6.0991 numMergedOcc 0
33 mol 134 unq 10 iso 0 dist 9.71307 9.94764 5.29786 4.00092 7.93372 9.0176 6.74887 10.9613 8.55616 9.48887 numMergedOcc 0
34 mol 134 unq 11 iso 0 dist 9.71307 9.94764 5.29786 4.00092 7.93372 9.0176 6.17103 5.42582 8.73604 5.67107 numMergedOcc 0
35 mol 143 unq 0 iso 0 dist 5.99315 7.78652 6.48978 4.78563 5.37047 5.06564 10.0989 9.60643 6.97487 5.43382 numMergedOcc 0
36 mol 143 unq 1 iso 0 dist 5.99315 7.78652 6.48978 4.78563 5.37047 5.06564 6.01455 9.27292 6.46089 4.38322 numMergedOcc 0
37 mol 155 unq 0 iso 0 dist 6.43582 7.92304 5.50031 4.91785 8.97626 9.16358 6.34186 7.51198 9.80845 4.48516 numMergedOcc 0
38 mol 181 unq 0 iso 0 dist 9.1374 8.90963 8.91338 12.9532 9.76212 17.8171 8.25067 13.2702 5.95304 20.3687 numMergedOcc 0
39 mol 181 unq 1 iso 0 dist 8.03334 6.59025 8.04639 6.50233 9.76212 11.6588 7.07409 10.7636 6.32777 9.04392 numMergedOcc 0
40 mol 181 unq 2 iso 0 dist 7.63312 5.9176 5.63555 10.6474 6.64173 8.12266 9.60512 7.98142 5.97685 4.48306 numMergedOcc 0
41 mol 181 unq 3 iso 0 dist 7.63312 5.9176 5.63555 10.6474 6.64173 8.12266 13.3389 7.37327 8.9289 4.88823 numMergedOcc 0
42 mol 181 unq 4 iso 0 dist 7.63312 5.9176 5.63555 5.93724 9.01624 10.5303 9.60512 7.98142 5.97685 12.2513 numMergedOcc 0
43 mol 181 unq 5 iso 0 dist 7.63312 5.9176 5.63555 5.93724 9.01624 10.5303 13.3389 7.37327 8.9289 14.8923 numMergedOcc 0
44 mol 181 unq 6 iso 0 dist 7.63312 5.9176 5.63555 5.12833 9.55105 9.43306 9.60512 7.98142 5.97685 10.2172 numMergedOcc 0
45 mol 181 unq 7 iso 0 dist 7.63312 5.9176 5.63555 5.12833 9.55105 9.43306 13.3389 7.37327 8.9289 14.2334 numMergedOcc 0
46 mol 192 unq 0 iso 0 dist 5.59424 8.77999 8.49529 9.53265 9.78634 15.7529 5.71262 8.36822 7.33225 10.3099 numMergedOcc 0
47 mol 192 unq 1 iso 0 dist 5.59424 8.77999 8.49529 6.35474 5.64942 13.3256 5.71262 8.36822 7.33225 10.1087 numMergedOcc 0
48 mol 192 unq 2 iso 0 dist 5.59424 8.77999 8.49529 5.25965 7.43054 13.7172 5.71262 8.36822 7.33225 10.0566 numMergedOcc 0
49 mol 192 unq 3 iso 0 dist 7.00794 8.77999 11.7523 6.35474 6.97962 13.3256 5.71262 12.1647 7.33225 10.1087 numMergedOcc 0
50 mol 192 unq 4 iso 0 dist 7.00794 8.77999 11.7523 5.25965 6.79229 13.7172 5.71262 12.1647 7.33225 10.0566 numMergedOcc 0
51 mol 224 unq 0 iso 0 dist 6.61986 9.51597 12.4692 5.13732 8.08349 10.7847 7.67202 12.6391 8.08737 5.93269 numMergedOcc 0
52 mol 227 unq 0 iso 0 dist 7.22101 5.41321 10.9607 5.0317 5.23634 8.91971 6.43754 8.17891 7.57454 4.09934 numMergedOcc 0
53 mol 227 unq 1 iso 0 dist 8.65997 5.41321 9.72615 5.0317 6.91318 8.91971 6.43754 6.95902 7.57454 4.09934 numMergedOcc 0
54 mol 232 unq 0 iso 0 dist 8.27212 9.40808 4.9377 5.10213 6.71524 9.9183 13.5597 11.4727 7.17337 14.5281 numMergedOcc 0
55 mol 259 unq 0 iso 0 dist 8.13497 7.98231 8.41846 8.8603 9.07743 14.6679 11.6195 10.9591 8.71497 14.0829 numMergedOcc 0
56 mol 259 unq 1 iso 0 dist 7.88519 7.98231 8.81835 7.20604 9.63573 11.547 11.6195 7.48005 8.71497 9.98303 numMergedOcc 0
57 mol 259 unq 2 iso 0 dist 7.88519 7.98231 8.81835 8.8603 7.66153 14.6679 11.6195 7.48005 8.71497 14.0829 numMergedOcc 0
58 mol 259 unq 3 iso 0 dist 7.46176 7.08526 8.81835 5.21606 9.63573 11.547 5.79468 7.48005 8.71497 9.98303 numMergedOcc 0
59 mol 259 unq 4 iso 0 dist 7.46176 7.08526 8.81835 11.8896 7.66153 14.6679 5.79468 7.48005 8.71497 14.0829 numMergedOcc 0
