0 mol 8 unq 0 iso 0 dist 6.4754 7.06064 9.62879 11.9453 8.4069 8.96553 13.8784 13.3876 8.27181 8.33604 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 6.57999 7.35767 9.62879 4.92734 8.4069 8.96553 7.0822 13.3876 8.27181 8.33604 numMergedOcc 0
2 mol 15 unq 0 iso 0 dist 9.70735 9.40358 9.97507 15.2545 9.03536 8.38064 9.5538 7.12903 5.90976 8.21493 numMergedOcc 0
3 mol 16 unq 0 iso 0 dist 6.84569 5.46269 5.46498 9.59856 5.32694 7.63133 5.66529 6.58035 5.94084 5.47769 numMergedOcc 0
4 mol 16 unq 1 iso 0 dist 6.84569 5.46269 5.46498 10.5516 5.74188 8.71745 6.32814 8.41862 6.73355 8.16785 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 8.20058 16.6906 8.86116 17.2959 10.0952 6.86014 20.5 12.4274 5.39241 9.75144 numMergedOcc 0
6 mol 72 unq 0 iso 0 dist 6.68311 15.0607 9.96708 10.1663 8.24309 9.78528 11.1274 12.0903 11.6894 9.02278 numMergedOcc 0
7 mol 73 unq 0 iso 0 dist 8.124 13.4367 6.19304 10.1112 5.4148 9.96396 10.0721 4.65521 7.41074 8.70133 numMergedOcc 0
8 mol 73 unq 1 iso 0 dist 8.16299 10.3774 8.70481 11.0108 14.9342 9.96396 15.2122 15.9587 7.41074 8.70133 numMergedOcc 0
9 mol 73 unq 2 iso 0 dist 8.16299 10.3774 8.70481 10.9082 13.3558 6.19304 15.2122 15.9587 7.41074 4.65521 numMergedOcc 0
10 mol 73 unq 3 iso 0 dist 8.27015 12.6626 8.70481 20.562 14.9342 9.96396 19.3744 15.9587 7.41074 8.70133 numMergedOcc 0
11 mol 73 unq 4 iso 0 dist 8.27015 12.6626 8.70481 17.327 13.3558 6.19304 19.3744 15.9587 7.41074 4.65521 numMergedOcc 0
12 mol 85 unq 0 iso 0 dist 6.56728 11.609 7.47541 13.2962 6.9948 7.97049 8.46482 7.22293 7.98917 9.47876 numMergedOcc 0
13 mol 85 unq 1 iso 0 dist 6.56728 13.5384 7.66905 13.2962 6.9948 6.19965 8.46482 7.22293 11.6116 9.47876 numMergedOcc 0
14 mol 100 unq 0 iso 0 dist 8.96916 5.92158 6.45675 5.70279 5.33144 7.47343 11.8754 11.8016 15.209 7.75343 numMergedOcc 0
15 mol 100 unq 1 iso 0 dist 5.70279 5.85449 6.65086 11.3277 5.88134 9.60661 11.8754 7.75343 10.9608 6.58204 numMergedOcc 0
16 mol 100 unq 2 iso 0 dist 5.70279 7.68675 6.56369 11.3277 5.88134 9.35224 11.8754 7.75343 5.69137 6.58204 numMergedOcc 0
17 mol 115 unq 0 iso 0 dist 8.97043 11.8721 9.33865 12.9647 7.69052 5.83991 7.266 9.66954 6.09023 8.66155 numMergedOcc 0
18 mol 115 unq 1 iso 0 dist 8.97043 5.19652 6.11741 12.9647 7.69052 7.88312 7.266 9.66954 4.61908 8.66155 numMergedOcc 0
19 mol 117 unq 0 iso 0 dist 7.0318 5.21051 7.90328 11.0698 7.22206 7.83136 5.70073 6.62561 4.91401 7.63616 numMergedOcc 0
20 mol 131 unq 0 iso 0 dist 9.33945 12.3624 8.40312 14.2573 5.55373 7.12972 18.1778 12.5969 6.19596 8.6243 numMergedOcc 0
21 mol 131 unq 1 iso 0 dist 9.33945 12.3624 8.40312 17.4482 10.7062 6.85062 18.1778 12.5969 6.19596 6.91348 numMergedOcc 0
22 mol 131 unq 2 iso 0 dist 9.33945 12.3624 8.40312 17.4482 10.7062 6.85062 14.7317 13.6559 6.6499 9.51418 numMergedOcc 0
23 mol 131 unq 3 iso 0 dist 8.99949 11.3502 6.85062 15.0798 6.63273 7.12972 9.45501 6.91348 6.19596 8.6243 numMergedOcc 0
24 mol 134 unq 0 iso 0 dist 7.27598 6.50005 6.37586 12.3933 5.49782 8.94367 7.26771 5.42582 5.41704 8.79571 numMergedOcc 0
25 mol 134 unq 1 iso 0 dist 7.27598 6.50005 6.37586 5.57904 5.00817 6.49416 7.26771 5.42582 5.41704 8.6355 numMergedOcc 0
26 mol 134 unq 2 iso 0 dist 7.27598 12.0971 9.71307 12.3933 5.49782 9.86662 7.26771 5.42582 6.17103 8.79571 numMergedOcc 0
27 mol 134 unq 3 iso 0 dist 5.57904 6.50005 6.49416 12.3933 8.80819 8.94367 7.26771 8.6355 5.41704 8.79571 numMergedOcc 0
28 mol 134 unq 4 iso 0 dist 5.57904 6.50005 6.49416 7.27598 5.00817 6.37586 7.26771 8.6355 5.41704 5.42582 numMergedOcc 0
29 mol 142 unq 0 iso 0 dist 9.14908 6.3846 5.31024 10.9228 5.32922 9.2313 11.8956 9.07935 9.49653 7.15475 numMergedOcc 0
30 mol 142 unq 1 iso 0 dist 9.14908 4.39297 7.26382 10.9228 5.32922 7.73169 11.8956 9.07935 7.53854 7.15475 numMergedOcc 0
31 mol 155 unq 0 iso 0 dist 5.68636 7.92939 6.43582 12.7322 7.66392 7.46303 14.0992 12.2465 6.3437 9.17284 numMergedOcc 0
32 mol 156 unq 0 iso 0 dist 9.19499 5.66289 7.44554 13.581 8.38403 9.83699 11.9162 9.36805 6.29785 7.55203 numMergedOcc 0
33 mol 156 unq 1 iso 0 dist 7.11647 5.66289 8.94056 9.19499 5.56175 7.44554 11.9162 13.1853 6.29785 9.36805 numMergedOcc 0
34 mol 156 unq 2 iso 0 dist 7.11647 5.66289 8.94056 13.581 11.2719 9.83699 11.9162 13.1853 6.29785 7.55203 numMergedOcc 0
35 mol 156 unq 3 iso 0 dist 9.68507 9.75709 7.66148 10.2339 10.1658 8.94056 5.32985 10.9818 8.67156 6.27641 numMergedOcc 0
36 mol 156 unq 4 iso 0 dist 7.98018 4.68187 9.83699 10.0213 8.38403 7.44554 4.71629 7.55203 6.29785 9.36805 numMergedOcc 0
37 mol 181 unq 0 iso 0 dist 8.90247 5.114 9.1374 10.3907 8.88798 5.98885 7.55781 10.2276 5.4601 7.20046 numMergedOcc 0
38 mol 181 unq 1 iso 0 dist 8.90247 5.114 9.1374 10.3907 8.88798 5.98885 12.8388 10.7636 10.0524 7.13543 numMergedOcc 0
39 mol 181 unq 2 iso 0 dist 8.90247 5.114 9.1374 13.7299 12.1628 9.15386 10.168 13.2702 8.25067 9.6668 numMergedOcc 0
40 mol 222 unq 0 iso 0 dist 8.7419 5.01062 6.00706 8.5834 6.8425 7.54212 4.78647 10.8957 7.61682 7.18956 numMergedOcc 0
41 mol 224 unq 0 iso 0 dist 7.75485 5.99647 5.81334 9.73411 5.60236 5.78342 9.9234 10.2775 5.3621 6.87664 numMergedOcc 0
42 mol 224 unq 1 iso 0 dist 9.11052 5.44863 5.81334 7.07564 5.60236 5.78342 4.92261 10.2775 5.3621 6.87664 numMergedOcc 0
43 mol 227 unq 0 iso 0 dist 9.60159 7.51316 7.22101 12.0857 5.22356 8.65997 14.7139 13.4493 14.6185 9.62609 numMergedOcc 0
44 mol 227 unq 1 iso 0 dist 9.60159 7.51316 7.22101 12.0857 5.22356 8.65997 7.35206 8.17891 6.43754 6.95902 numMergedOcc 0
45 mol 227 unq 2 iso 0 dist 9.60159 7.51316 7.22101 14.7829 12.4689 7.55216 16.0417 15.9414 11.662 8.83563 numMergedOcc 0
46 mol 227 unq 3 iso 0 dist 7.71761 5.841 7.55216 12.9898 12.4689 7.22101 10.2228 12.8864 6.43754 8.17891 numMergedOcc 0
47 mol 227 unq 4 iso 0 dist 7.71761 5.841 7.55216 14.1659 12.9332 8.65997 18.3925 19.8174 14.6185 9.62609 numMergedOcc 0
48 mol 227 unq 5 iso 0 dist 7.71761 5.841 7.55216 14.1659 12.9332 8.65997 10.2228 12.8864 6.43754 6.95902 numMergedOcc 0
49 mol 238 unq 0 iso 0 dist 4.87108 7.45873 6.22714 7.64276 5.34096 7.31233 13.9044 10.5202 10.4664 6.55759 numMergedOcc 0
50 mol 238 unq 1 iso 0 dist 4.87108 7.45873 6.22714 7.64276 5.34096 7.31233 13.3748 12.1784 11.2717 7.02475 numMergedOcc 0
51 mol 238 unq 2 iso 0 dist 4.87108 7.45873 6.22714 7.64276 5.34096 7.31233 11.6924 12.1937 12.6986 7.67322 numMergedOcc 0
52 mol 238 unq 3 iso 0 dist 4.87108 7.45873 6.22714 7.64276 5.34096 7.31233 5.61491 7.49471 5.17471 7.19008 numMergedOcc 0
53 mol 238 unq 4 iso 0 dist 7.64276 7.45873 7.31233 4.87108 5.34096 6.22714 5.61491 7.19008 5.17471 7.49471 numMergedOcc 0
54 mol 238 unq 5 iso 0 dist 6.54455 5.17954 6.22714 10.2875 5.34096 7.31233 14.9109 10.5202 10.4664 6.55759 numMergedOcc 0
55 mol 238 unq 6 iso 0 dist 6.54455 5.17954 6.22714 10.2875 5.34096 7.31233 15.5439 12.1784 11.2717 7.02475 numMergedOcc 0
56 mol 238 unq 7 iso 0 dist 6.54455 5.17954 6.22714 10.2875 5.34096 7.31233 15.5289 12.1937 12.6986 7.67322 numMergedOcc 0
57 mol 238 unq 8 iso 0 dist 6.54455 5.17954 6.22714 10.2875 5.34096 7.31233 6.74728 7.49471 5.17471 7.19008 numMergedOcc 0
58 mol 272 unq 0 iso 0 dist 7.31993 10.4451 8.46116 12.3168 5.40809 8.33638 13.7563 9.09992 5.63139 6.73206 numMergedOcc 0
