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 10.5461 13.2247 5.03847 9.87885 6.36911 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 10.5461 13.2247 5.03847 14.1836 6.36911 numMergedOcc 0
2 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 14.7815 17.503 10.9183 15.1065 9.53002 numMergedOcc 0
3 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 7.32874 5.47421 7.12541 8.69057 6.40841 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 6.81627 7.21955 7.09066 5.61579 5.38524 10.4354 6.75888 10.335 8.71468 11.0945 13.4544 15.6564 11.387 18.0198 7.58407 numMergedOcc 0
5 mol 58 unq 2 iso 0 dist 6.81627 7.21955 7.09066 5.61579 5.38524 10.4354 6.75888 10.335 8.71468 11.0945 9.55426 9.7274 5.74871 13.1897 6.31428 numMergedOcc 0
6 mol 58 unq 3 iso 0 dist 7.32874 7.21955 7.12541 5.61579 8.69057 10.4354 6.75888 6.40841 8.71468 11.0945 13.4544 11.0466 11.387 18.0198 7.58407 numMergedOcc 0
7 mol 58 unq 4 iso 0 dist 7.32874 7.21955 7.12541 5.61579 8.69057 10.4354 6.75888 6.40841 8.71468 11.0945 9.55426 5.90225 5.74871 13.1897 6.31428 numMergedOcc 0
8 mol 58 unq 5 iso 0 dist 6.62496 8.80614 9.95364 9.87158 9.22598 9.01564 13.9007 16.3613 7.6481 10.7557 18.1669 19.1436 9.62267 16.6126 8.81638 numMergedOcc 0
9 mol 58 unq 6 iso 0 dist 6.62496 8.80614 9.95364 9.87158 9.22598 9.01564 6.47744 11.5023 9.11258 14.6599 6.86465 5.30792 10.2049 13.3281 8.63333 numMergedOcc 0
10 mol 58 unq 7 iso 0 dist 6.62496 8.80614 9.95364 9.87158 9.22598 9.01564 6.47744 11.5023 9.11258 14.6599 6.35756 4.81926 5.49591 8.96727 8.89374 numMergedOcc 0
11 mol 58 unq 8 iso 0 dist 6.62496 8.80614 9.95364 9.87158 9.22598 9.01564 6.47744 11.5023 9.11258 14.6599 10.3224 13.1243 5.85698 14.4498 6.46761 numMergedOcc 0
12 mol 58 unq 9 iso 0 dist 6.62496 8.80614 9.95364 9.87158 9.22598 9.01564 6.47744 11.5023 9.11258 14.6599 15.4557 18.3276 12.2123 20.9029 9.73139 numMergedOcc 0
13 mol 58 unq 10 iso 0 dist 6.35756 8.80614 5.49591 9.87158 8.96727 9.01564 13.9007 12.7237 7.6481 10.7557 18.1669 14.5118 9.62267 16.6126 8.81638 numMergedOcc 0
14 mol 58 unq 11 iso 0 dist 6.35756 8.80614 5.49591 9.87158 8.96727 9.01564 6.47744 8.89374 9.11258 14.6599 6.86465 5.35073 10.2049 13.3281 8.63333 numMergedOcc 0
15 mol 58 unq 12 iso 0 dist 6.35756 8.80614 5.49591 9.87158 8.96727 9.01564 6.47744 8.89374 9.11258 14.6599 10.3224 8.62958 5.85698 14.4498 6.46761 numMergedOcc 0
16 mol 58 unq 13 iso 0 dist 6.35756 8.80614 5.49591 9.87158 8.96727 9.01564 6.47744 8.89374 9.11258 14.6599 15.4557 14.176 12.2123 20.9029 9.73139 numMergedOcc 0
17 mol 58 unq 14 iso 0 dist 6.35756 8.80614 5.49591 5.86526 8.01308 7.11065 13.9007 12.7237 7.6481 9.1083 18.1669 14.5118 9.62267 15.5317 8.81638 numMergedOcc 0
18 mol 58 unq 15 iso 0 dist 6.35756 8.80614 5.49591 5.86526 8.01308 7.11065 6.47744 8.89374 9.11258 9.47022 6.86465 5.35073 10.2049 11.5155 8.63333 numMergedOcc 0
19 mol 58 unq 16 iso 0 dist 6.35756 8.80614 5.49591 5.86526 8.01308 7.11065 6.47744 8.89374 9.11258 9.47022 10.3224 8.62958 5.85698 10.6166 6.46761 numMergedOcc 0
20 mol 58 unq 17 iso 0 dist 6.35756 8.80614 5.49591 5.86526 8.01308 7.11065 6.47744 8.89374 9.11258 9.47022 15.4557 14.176 12.2123 16.7574 9.73139 numMergedOcc 0
21 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 14.5656 10.6748 11.4485 16.9931 9.54144 numMergedOcc 0
22 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 11.4799 7.4697 8.44406 10.9476 5.64598 numMergedOcc 0
23 mol 73 unq 1 iso 0 dist 9.96396 9.24757 5.11416 5.70116 9.73086 6.14542 7.41074 8.70133 7.10439 6.15714 6.19304 5.4148 6.56633 7.4369 4.65521 numMergedOcc 0
24 mol 73 unq 2 iso 0 dist 6.19304 9.24757 6.56633 6.20232 8.68662 8.96616 7.41074 4.65521 7.10439 6.10063 9.96396 5.4148 5.11416 12.2276 8.70133 numMergedOcc 0
25 mol 73 unq 3 iso 0 dist 6.19304 9.24757 6.56633 6.20232 8.68662 8.96616 7.41074 4.65521 7.10439 6.10063 11.4799 5.7113 8.44406 11.6739 5.64598 numMergedOcc 0
26 mol 73 unq 4 iso 0 dist 6.19304 9.24757 6.56633 5.70116 7.4369 6.14542 7.41074 4.65521 7.10439 6.15714 9.96396 5.4148 5.11416 9.73086 8.70133 numMergedOcc 0
27 mol 73 unq 5 iso 0 dist 6.19304 9.24757 6.56633 5.70116 7.4369 6.14542 7.41074 4.65521 7.10439 6.15714 11.4799 5.7113 8.44406 10.9476 5.64598 numMergedOcc 0
28 mol 73 unq 6 iso 0 dist 8.70481 9.24757 15.3808 11.2069 5.5087 14.6027 7.41074 15.9587 7.10439 17.2861 9.96396 14.9342 5.11416 13.3207 8.70133 numMergedOcc 0
29 mol 73 unq 7 iso 0 dist 8.70481 9.24757 15.3808 11.2069 5.5087 14.6027 7.41074 15.9587 7.10439 17.2861 11.4799 19.0652 8.44406 19.2161 5.64598 numMergedOcc 0
30 mol 73 unq 8 iso 0 dist 8.70481 9.24757 15.3808 11.2069 5.5087 14.6027 7.41074 15.9587 7.10439 17.2861 6.19304 13.3558 6.56633 13.8368 4.65521 numMergedOcc 0
31 mol 73 unq 9 iso 0 dist 8.70481 9.24757 15.3808 10.6713 6.08682 13.8591 7.41074 15.9587 7.10439 16.8311 9.96396 14.9342 5.11416 14.498 8.70133 numMergedOcc 0
32 mol 73 unq 10 iso 0 dist 8.70481 9.24757 15.3808 10.6713 6.08682 13.8591 7.41074 15.9587 7.10439 16.8311 11.4799 19.0652 8.44406 19.9763 5.64598 numMergedOcc 0
33 mol 73 unq 11 iso 0 dist 8.70481 9.24757 15.3808 10.6713 6.08682 13.8591 7.41074 15.9587 7.10439 16.8311 6.19304 13.3558 6.56633 14.5999 4.65521 numMergedOcc 0
34 mol 92 unq 0 iso 0 dist 7.4729 6.95572 9.50382 4.46885 8.3773 9.92987 6.99832 5.81965 5.39745 7.94489 11.862 5.02055 11.3858 12.4353 7.06013 numMergedOcc 0
35 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 6.82344 8.95922 7.56363 11.1432 9.70512 numMergedOcc 0
36 mol 134 unq 0 iso 0 dist 8.94367 6.23142 4.57832 8.06642 7.21868 9.0176 5.41704 8.79571 8.73604 5.67107 6.37586 5.49782 5.29786 7.93372 5.42582 numMergedOcc 0
37 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 6.49416 8.80819 5.71679 11.988 8.6355 numMergedOcc 0
38 mol 134 unq 2 iso 0 dist 6.37586 6.23142 5.29786 6.95573 9.33924 12.2587 5.41704 5.42582 8.73604 6.0991 8.94367 5.49782 4.57832 13.9752 8.79571 numMergedOcc 0
39 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 6.49416 5.00817 5.71679 9.55584 8.6355 numMergedOcc 0
40 mol 134 unq 4 iso 0 dist 6.37586 6.23142 5.29786 8.06642 7.93372 9.0176 5.41704 5.42582 8.73604 5.67107 8.94367 5.49782 4.57832 7.21868 8.79571 numMergedOcc 0
41 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 6.49416 5.00817 5.71679 11.988 8.6355 numMergedOcc 0
42 mol 134 unq 6 iso 0 dist 9.86662 9.94764 4.57832 4.00092 7.21868 9.0176 6.17103 8.79571 8.73604 5.67107 9.71307 5.49782 5.29786 7.93372 5.42582 numMergedOcc 0
43 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 12.5075 8.80819 5.71679 11.988 8.6355 numMergedOcc 0
44 mol 134 unq 8 iso 0 dist 9.71307 9.94764 5.29786 10.2026 9.33924 12.2587 6.17103 5.42582 8.73604 6.0991 9.86662 5.49782 4.57832 13.9752 8.79571 numMergedOcc 0
45 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 12.5075 5.00817 5.71679 9.55584 8.6355 numMergedOcc 0
46 mol 134 unq 10 iso 0 dist 9.71307 9.94764 5.29786 4.00092 7.93372 9.0176 6.17103 5.42582 8.73604 5.67107 9.86662 5.49782 4.57832 7.21868 8.79571 numMergedOcc 0
47 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 12.5075 5.00817 5.71679 11.988 8.6355 numMergedOcc 0
48 mol 143 unq 0 iso 0 dist 5.99315 7.78652 6.48978 4.78563 5.37047 5.06564 6.01455 9.27292 6.46089 4.38322 10.6877 14.4073 10.0059 10.9972 7.31468 numMergedOcc 0
49 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 12.7524 14.5751 8.57817 10.7327 7.7056 numMergedOcc 0
50 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 10.2463 5.71071 11.0769 12.9034 9.86313 numMergedOcc 0
51 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 9.15386 12.1628 9.34211 18.2853 9.6668 numMergedOcc 0
52 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 10.7062 8.88798 5.77299 13.2783 7.13543 numMergedOcc 0
53 mol 192 unq 0 iso 0 dist 7.00794 8.77999 11.7523 6.35474 6.97962 13.3256 5.71262 12.1647 7.33225 10.1087 5.59424 5.76246 8.49529 5.64942 8.36822 numMergedOcc 0
54 mol 192 unq 1 iso 0 dist 7.00794 8.77999 11.7523 5.25965 6.79229 13.7172 5.71262 12.1647 7.33225 10.0566 5.59424 5.76246 8.49529 7.43054 8.36822 numMergedOcc 0
55 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 8.65997 5.22356 9.72615 6.91318 6.95902 numMergedOcc 0
56 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 7.22101 5.22356 10.9607 5.23634 8.17891 numMergedOcc 0
57 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 7.88519 4.69778 8.81835 7.66153 7.48005 numMergedOcc 0
58 mol 259 unq 1 iso 0 dist 8.13497 7.98231 8.41846 8.8603 9.07743 14.6679 11.6195 10.9591 8.71497 14.0829 15.9169 13.2121 8.75685 20.1127 8.37865 numMergedOcc 0
59 mol 259 unq 2 iso 0 dist 7.88519 7.98231 8.81835 7.20604 9.63573 11.547 11.6195 7.48005 8.71497 9.98303 15.9169 12.5353 8.75685 17.0253 8.37865 numMergedOcc 0
60 mol 259 unq 3 iso 0 dist 7.88519 7.98231 8.81835 8.8603 7.66153 14.6679 11.6195 7.48005 8.71497 14.0829 15.9169 12.5353 8.75685 20.1127 8.37865 numMergedOcc 0
61 mol 259 unq 4 iso 0 dist 7.46176 7.08526 8.81835 5.21606 9.63573 11.547 5.79468 7.48005 8.71497 9.98303 11.858 12.5353 8.75685 17.0253 8.37865 numMergedOcc 0
62 mol 259 unq 5 iso 0 dist 7.46176 7.08526 8.81835 11.8896 7.66153 14.6679 5.79468 7.48005 8.71497 14.0829 11.858 12.5353 8.75685 20.1127 8.37865 numMergedOcc 0
