0 mol 7 unq 0 iso 0 dist 8.41585 6.36911 6.06176 6.88805 5.99459 8.81608 10.5461 12.2041 10.515 9.67164 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.10621 7.31201 10.789 13.156 9.67164 14.144 12.2333 12.2041 12.2708 5.99459 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.10621 9.36807 10.515 13.156 9.67164 8.81608 12.2333 12.2041 6.06176 5.99459 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 8.80331 9.83618 10.4442 5.41726 6.6263 13.07 6.20293 8.13395 9.49077 6.75943 numMergedOcc 0
4 mol 43 unq 1 iso 0 dist 6.20293 9.83618 9.49077 5.41726 6.75943 13.07 8.80331 8.13395 10.4442 6.6263 numMergedOcc 0
5 mol 58 unq 0 iso 0 dist 6.81627 8.26899 5.98837 5.61579 5.38524 7.03126 11.715 5.79773 10.8078 8.66539 numMergedOcc 0
6 mol 58 unq 1 iso 0 dist 6.81627 8.26899 5.98837 5.61579 5.38524 7.03126 7.32874 5.47421 4.55117 8.69057 numMergedOcc 0
7 mol 58 unq 2 iso 0 dist 7.32874 8.26899 4.55117 5.61579 8.69057 7.03126 11.715 10.8779 10.8078 8.66539 numMergedOcc 0
8 mol 58 unq 3 iso 0 dist 7.32874 8.26899 4.55117 5.61579 8.69057 7.03126 6.81627 5.47421 5.98837 5.38524 numMergedOcc 0
9 mol 58 unq 4 iso 0 dist 6.62496 9.58673 10.2241 9.87158 9.22598 15.7229 6.35756 4.81926 7.05413 8.96727 numMergedOcc 0
10 mol 58 unq 5 iso 0 dist 6.35756 9.58673 7.05413 9.87158 8.96727 15.7229 6.62496 4.81926 10.2241 9.22598 numMergedOcc 0
11 mol 58 unq 6 iso 0 dist 6.64012 6.46761 5.24906 4.00553 9.08221 10.1478 10.3988 7.5247 12.5636 9.97769 numMergedOcc 0
12 mol 58 unq 7 iso 0 dist 6.64012 6.46761 5.24906 4.00553 9.08221 10.1478 11.221 10.0658 14.2903 9.32706 numMergedOcc 0
13 mol 58 unq 8 iso 0 dist 6.64012 7.58407 5.11205 4.00553 9.08221 10.7327 10.3988 7.5247 9.95096 9.97769 numMergedOcc 0
14 mol 58 unq 9 iso 0 dist 6.64012 7.58407 5.11205 4.00553 9.08221 10.7327 11.221 10.0658 13.7167 9.32706 numMergedOcc 0
15 mol 58 unq 10 iso 0 dist 9.4099 9.73139 5.24906 8.55984 9.08221 10.1478 11.9025 7.5247 12.5636 9.97769 numMergedOcc 0
16 mol 58 unq 11 iso 0 dist 9.4099 9.73139 5.24906 8.55984 9.08221 10.1478 14.7109 10.0658 14.2903 9.32706 numMergedOcc 0
17 mol 58 unq 12 iso 0 dist 9.4099 6.31428 5.11205 8.55984 9.08221 10.7327 11.9025 7.5247 9.95096 9.97769 numMergedOcc 0
18 mol 58 unq 13 iso 0 dist 9.4099 6.31428 5.11205 8.55984 9.08221 10.7327 14.7109 10.0658 13.7167 9.32706 numMergedOcc 0
19 mol 72 unq 0 iso 0 dist 9.96708 7.321 9.0131 7.47371 7.12321 9.14817 10.8086 5.36766 6.00418 9.74228 numMergedOcc 0
20 mol 72 unq 1 iso 0 dist 9.96708 7.321 9.0131 7.47371 7.12321 9.14817 9.78528 8.24309 6.11922 6.21799 numMergedOcc 0
21 mol 72 unq 2 iso 0 dist 9.78528 7.321 6.11922 7.47371 6.21799 9.14817 10.8086 7.04035 6.00418 9.74228 numMergedOcc 0
22 mol 72 unq 3 iso 0 dist 9.78528 7.321 6.11922 7.47371 6.21799 9.14817 9.96708 8.24309 9.0131 7.12321 numMergedOcc 0
23 mol 72 unq 4 iso 0 dist 9.78528 7.321 6.11922 9.67587 5.03251 9.76686 15.1902 5.8486 9.93049 9.56773 numMergedOcc 0
24 mol 88 unq 0 iso 0 dist 9.36773 9.2603 6.95868 12.1193 7.80898 12.9048 16.8013 12.1547 14.5201 7.51139 numMergedOcc 0
25 mol 100 unq 0 iso 0 dist 9.60661 6.58204 10.9608 4.03277 8.91882 10.259 10.1489 10.8375 14.0755 9.21662 numMergedOcc 0
26 mol 100 unq 1 iso 0 dist 6.65086 7.75343 10.9608 6.23008 8.91882 10.259 13.2001 10.8375 14.0755 9.21662 numMergedOcc 0
27 mol 109 unq 0 iso 0 dist 8.69985 5.87358 9.46098 5.00433 8.52024 9.74008 13.1098 7.15843 15.054 9.89083 numMergedOcc 0
28 mol 115 unq 0 iso 0 dist 9.33865 7.76729 10.7942 6.63111 6.39384 8.0168 5.83991 7.69052 10.9739 9.42082 numMergedOcc 0
29 mol 115 unq 1 iso 0 dist 5.83991 7.76729 10.9739 6.63111 9.42082 8.0168 9.33865 7.69052 10.7942 6.39384 numMergedOcc 0
30 mol 115 unq 2 iso 0 dist 6.11741 6.99777 10.8292 6.07067 6.39384 12.9982 7.88312 7.69052 11.7126 9.42082 numMergedOcc 0
31 mol 115 unq 3 iso 0 dist 6.11741 9.14376 6.12943 6.07067 6.39384 10.7985 7.88312 7.69052 4.62962 9.42082 numMergedOcc 0
32 mol 115 unq 4 iso 0 dist 7.88312 6.99777 11.7126 6.07067 9.42082 12.9982 6.11741 7.69052 10.8292 6.39384 numMergedOcc 0
33 mol 115 unq 5 iso 0 dist 7.88312 9.14376 4.62962 6.07067 9.42082 10.7985 6.11741 7.69052 6.12943 6.39384 numMergedOcc 0
34 mol 119 unq 0 iso 0 dist 8.73993 9.63176 10.6679 9.68677 7.64052 9.08536 16.4353 9.93257 16.7975 8.95212 numMergedOcc 0
35 mol 119 unq 1 iso 0 dist 8.73993 9.63176 10.6679 9.68677 7.64052 9.08536 10.3704 4.85907 7.36192 6.99446 numMergedOcc 0
36 mol 119 unq 2 iso 0 dist 9.87172 9.38288 11.7228 6.20019 6.99446 12.4009 13.9919 10.9871 15.7542 8.95212 numMergedOcc 0
37 mol 119 unq 3 iso 0 dist 9.87172 9.38288 11.7228 6.20019 6.99446 12.4009 12.6489 4.85907 16.1459 7.64052 numMergedOcc 0
38 mol 119 unq 4 iso 0 dist 9.87172 6.19042 6.35763 6.20019 6.99446 6.13374 13.9919 10.9871 10.3457 8.95212 numMergedOcc 0
39 mol 119 unq 5 iso 0 dist 9.87172 6.19042 6.35763 6.20019 6.99446 6.13374 12.6489 4.85907 10.0197 7.64052 numMergedOcc 0
40 mol 119 unq 6 iso 0 dist 9.87172 7.44174 7.36192 6.20019 6.99446 9.08536 13.9919 10.9871 16.7975 8.95212 numMergedOcc 0
41 mol 119 unq 7 iso 0 dist 9.87172 7.44174 7.36192 6.20019 6.99446 9.08536 12.6489 4.85907 10.6679 7.64052 numMergedOcc 0
42 mol 119 unq 8 iso 0 dist 6.18601 9.80862 9.35964 4.39676 8.95212 9.56225 10.1813 10.9871 9.64166 6.99446 numMergedOcc 0
43 mol 119 unq 9 iso 0 dist 6.18601 9.80862 9.35964 4.39676 8.95212 9.56225 9.72413 9.93257 12.6801 7.64052 numMergedOcc 0
44 mol 119 unq 10 iso 0 dist 6.18601 8.43904 10.3457 4.39676 8.95212 6.13374 10.1813 10.9871 6.35763 6.99446 numMergedOcc 0
45 mol 119 unq 11 iso 0 dist 6.18601 8.43904 10.3457 4.39676 8.95212 6.13374 9.72413 9.93257 10.0197 7.64052 numMergedOcc 0
46 mol 134 unq 0 iso 0 dist 8.94367 8.79571 5.41704 7.41373 9.33094 11.7151 9.86662 6.81259 6.17103 8.69531 numMergedOcc 0
47 mol 134 unq 1 iso 0 dist 6.37586 5.42582 5.41704 10.8635 9.33094 11.7151 9.71307 6.81259 6.17103 8.69531 numMergedOcc 0
48 mol 134 unq 2 iso 0 dist 6.49416 8.6355 5.41704 12.3479 9.33094 11.7151 12.5075 6.81259 6.17103 8.69531 numMergedOcc 0
49 mol 134 unq 3 iso 0 dist 9.86662 8.79571 6.17103 12.8086 9.1998 14.0978 15.281 11.6064 14.8449 6.42772 numMergedOcc 0
50 mol 134 unq 4 iso 0 dist 9.86662 8.79571 6.17103 12.8086 9.1998 14.0978 14.0375 7.09823 13.0122 8.70621 numMergedOcc 0
51 mol 134 unq 5 iso 0 dist 9.86662 8.79571 6.17103 7.41373 8.69531 11.7151 8.94367 6.81259 5.41704 9.33094 numMergedOcc 0
52 mol 134 unq 6 iso 0 dist 9.71307 5.42582 6.17103 15.0225 9.1998 14.0978 15.6507 11.6064 14.8449 6.42772 numMergedOcc 0
53 mol 134 unq 7 iso 0 dist 9.71307 5.42582 6.17103 15.0225 9.1998 14.0978 15.9508 7.09823 13.0122 8.70621 numMergedOcc 0
54 mol 134 unq 8 iso 0 dist 9.71307 5.42582 6.17103 10.8635 8.69531 11.7151 6.37586 6.81259 5.41704 9.33094 numMergedOcc 0
55 mol 152 unq 0 iso 0 dist 8.56324 9.13561 5.99333 5.39112 6.59889 10.5081 6.70283 7.65448 8.25411 6.70693 numMergedOcc 0
56 mol 152 unq 1 iso 0 dist 6.70283 9.13561 8.25411 5.39112 6.70693 10.5081 8.56324 7.65448 5.99333 6.59889 numMergedOcc 0
57 mol 181 unq 0 iso 0 dist 9.1374 6.94688 6.25083 12.9532 9.76212 14.5897 9.94371 6.01247 10.5753 8.59874 numMergedOcc 0
58 mol 181 unq 1 iso 0 dist 9.1374 6.71012 4.77278 12.9532 9.76212 12.3788 9.94371 6.01247 5.88819 8.59874 numMergedOcc 0
59 mol 181 unq 2 iso 0 dist 7.81386 4.93785 6.7991 5.71898 9.01624 6.76746 9.81747 11.5866 8.35755 5.05973 numMergedOcc 0
60 mol 181 unq 3 iso 0 dist 7.63312 6.93764 4.80231 5.93724 9.01624 10.1634 9.11469 11.5866 11.4616 5.05973 numMergedOcc 0
61 mol 224 unq 0 iso 0 dist 6.61986 8.19953 10.7113 5.13732 8.08349 5.73591 13.4025 10.3613 11.4252 9.78218 numMergedOcc 0
62 mol 224 unq 1 iso 0 dist 6.57273 6.87664 7.12232 7.05804 8.79428 10.8888 10.103 6.77699 12.6949 6.99769 numMergedOcc 0
63 mol 224 unq 2 iso 0 dist 6.57273 6.87664 7.12232 7.05804 8.79428 10.8888 5.78342 8.49799 5.3621 6.8692 numMergedOcc 0
64 mol 224 unq 3 iso 0 dist 5.78342 6.87664 5.3621 7.05804 6.8692 10.8888 10.103 11.328 12.6949 6.99769 numMergedOcc 0
65 mol 224 unq 4 iso 0 dist 5.78342 6.87664 5.3621 7.05804 6.8692 10.8888 6.57273 8.49799 7.12232 8.79428 numMergedOcc 0
66 mol 238 unq 0 iso 0 dist 6.22714 7.49471 5.17471 12.7938 9.08509 5.43613 11.0896 10.1813 5.54325 6.99888 numMergedOcc 0
67 mol 238 unq 1 iso 0 dist 7.31233 6.55759 10.4664 11.0772 9.08509 14.4363 11.5794 10.1813 17.2608 6.99888 numMergedOcc 0
68 mol 238 unq 2 iso 0 dist 7.31233 7.02475 11.2717 11.0772 9.08509 10.529 11.5794 10.1813 14.2685 6.99888 numMergedOcc 0
69 mol 238 unq 3 iso 0 dist 7.31233 7.67322 12.6986 11.0772 9.08509 9.99105 11.5794 10.1813 11.6239 6.99888 numMergedOcc 0
70 mol 238 unq 4 iso 0 dist 7.31233 7.19008 5.17471 11.0772 9.08509 5.43613 11.5794 10.1813 5.54325 6.99888 numMergedOcc 0
71 mol 259 unq 0 iso 0 dist 7.88519 7.48005 11.6195 11.6988 9.46361 9.43105 7.46176 6.96053 5.79468 6.95511 numMergedOcc 0
72 mol 259 unq 1 iso 0 dist 7.46176 7.48005 5.79468 10.067 5.85442 6.23661 12.0576 9.98105 5.31048 6.9899 numMergedOcc 0
73 mol 259 unq 2 iso 0 dist 7.46176 7.48005 5.79468 11.6988 6.95511 9.43105 7.88519 6.96053 11.6195 9.46361 numMergedOcc 0
74 mol 259 unq 3 iso 0 dist 5.30224 8.37865 5.31048 7.09907 6.9899 6.23661 11.858 9.98105 5.79468 5.85442 numMergedOcc 0
