0 mol 43 unq 0 iso 0 dist 6.20293 5.73819 5.06502 6.75943 5.41726 4.96926 9.49077 9.83618 13.5377 13.07 8.13395 8.80331 10.5523 6.6263 10.4442 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 6.20293 8.93915 6.45462 6.75943 5.41726 10.0383 9.49077 9.83618 13.7177 13.07 8.13395 8.80331 14.7803 6.6263 10.4442 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 6.64012 9.4099 6.47414 9.08221 4.00553 8.55984 5.24906 6.46761 9.73139 10.1478 7.5247 10.3988 11.9025 9.97769 12.5636 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 6.64012 9.4099 6.47414 9.08221 4.00553 8.55984 5.24906 6.46761 9.73139 10.1478 10.0658 11.221 14.7109 9.32706 14.2903 numMergedOcc 0
4 mol 58 unq 2 iso 0 dist 6.64012 9.4099 6.47414 9.08221 4.00553 8.55984 5.11205 7.58407 6.31428 10.7327 7.5247 10.3988 11.9025 9.97769 9.95096 numMergedOcc 0
5 mol 58 unq 3 iso 0 dist 6.64012 9.4099 6.47414 9.08221 4.00553 8.55984 5.11205 7.58407 6.31428 10.7327 10.0658 11.221 14.7109 9.32706 13.7167 numMergedOcc 0
6 mol 58 unq 4 iso 0 dist 9.4099 6.64012 6.47414 9.08221 8.55984 4.00553 5.24906 9.73139 6.46761 10.1478 7.5247 11.9025 10.3988 9.97769 12.5636 numMergedOcc 0
7 mol 58 unq 5 iso 0 dist 9.4099 6.64012 6.47414 9.08221 8.55984 4.00553 5.24906 9.73139 6.46761 10.1478 10.0658 14.7109 11.221 9.32706 14.2903 numMergedOcc 0
8 mol 58 unq 6 iso 0 dist 9.4099 6.64012 6.47414 9.08221 8.55984 4.00553 5.11205 6.31428 7.58407 10.7327 7.5247 11.9025 10.3988 9.97769 9.95096 numMergedOcc 0
9 mol 58 unq 7 iso 0 dist 9.4099 6.64012 6.47414 9.08221 8.55984 4.00553 5.11205 6.31428 7.58407 10.7327 10.0658 14.7109 11.221 9.32706 13.7167 numMergedOcc 0
10 mol 72 unq 0 iso 0 dist 9.96708 8.8178 10.7394 7.12321 7.47371 4.27726 9.0131 7.321 13.3133 9.14817 5.36766 10.8086 12.8385 9.74228 6.00418 numMergedOcc 0
11 mol 72 unq 1 iso 0 dist 9.96708 8.8178 10.7394 7.12321 7.47371 4.27726 9.0131 7.321 13.3133 9.14817 8.24309 9.78528 9.84449 6.21799 6.11922 numMergedOcc 0
12 mol 100 unq 0 iso 0 dist 9.60661 6.65086 5.88134 8.91882 4.03277 6.23008 10.9608 6.58204 7.75343 10.259 10.8375 10.1489 13.2001 9.21662 14.0755 numMergedOcc 0
13 mol 100 unq 1 iso 0 dist 6.65086 9.60661 5.88134 8.91882 6.23008 4.03277 10.9608 7.75343 6.58204 10.259 10.8375 13.2001 10.1489 9.21662 14.0755 numMergedOcc 0
14 mol 115 unq 0 iso 0 dist 9.33865 6.11741 8.02349 6.39384 6.63111 6.07067 10.7942 7.76729 12.9821 8.0168 7.69052 5.83991 7.88312 9.42082 10.9739 numMergedOcc 0
15 mol 115 unq 1 iso 0 dist 5.83991 7.30858 10.8507 9.42082 6.63111 15.3161 10.9739 7.76729 17.6696 8.0168 7.69052 9.33865 13.8473 6.39384 10.7942 numMergedOcc 0
16 mol 115 unq 2 iso 0 dist 5.83991 7.88312 8.02349 9.42082 6.63111 6.07067 10.9739 7.76729 12.9821 8.0168 7.69052 9.33865 6.11741 6.39384 10.7942 numMergedOcc 0
17 mol 115 unq 3 iso 0 dist 6.11741 9.33865 8.02349 6.39384 6.07067 6.63111 10.8292 6.99777 13.9977 12.9982 7.69052 7.88312 5.83991 9.42082 11.7126 numMergedOcc 0
18 mol 115 unq 4 iso 0 dist 6.11741 9.33865 8.02349 6.39384 6.07067 6.63111 6.12943 9.14376 9.65429 10.7985 7.69052 7.88312 5.83991 9.42082 4.62962 numMergedOcc 0
19 mol 115 unq 5 iso 0 dist 7.88312 7.30858 11.5723 9.42082 6.07067 15.3161 11.7126 6.99777 11.695 12.9982 7.69052 6.11741 13.8473 6.39384 10.8292 numMergedOcc 0
20 mol 115 unq 6 iso 0 dist 7.88312 7.30858 11.5723 9.42082 6.07067 15.3161 4.62962 9.14376 10.0603 10.7985 7.69052 6.11741 13.8473 6.39384 6.12943 numMergedOcc 0
21 mol 115 unq 7 iso 0 dist 7.88312 5.83991 8.02349 9.42082 6.07067 6.63111 11.7126 6.99777 13.9977 12.9982 7.69052 6.11741 9.33865 6.39384 10.8292 numMergedOcc 0
22 mol 115 unq 8 iso 0 dist 7.88312 5.83991 8.02349 9.42082 6.07067 6.63111 4.62962 9.14376 9.65429 10.7985 7.69052 6.11741 9.33865 6.39384 6.12943 numMergedOcc 0
23 mol 134 unq 0 iso 0 dist 8.94367 6.37586 5.49782 9.33094 7.41373 10.8635 5.41704 8.79571 5.42582 11.7151 6.81259 9.86662 9.71307 8.69531 6.17103 numMergedOcc 0
24 mol 134 unq 1 iso 0 dist 8.94367 6.49416 8.80819 9.33094 7.41373 12.3479 5.41704 8.79571 8.6355 11.7151 6.81259 9.86662 12.5075 8.69531 6.17103 numMergedOcc 0
25 mol 134 unq 2 iso 0 dist 6.37586 8.94367 5.49782 9.33094 10.8635 7.41373 5.41704 5.42582 8.79571 11.7151 6.81259 9.71307 9.86662 8.69531 6.17103 numMergedOcc 0
26 mol 134 unq 3 iso 0 dist 6.37586 6.49416 5.00817 9.33094 10.8635 12.3479 5.41704 5.42582 8.6355 11.7151 6.81259 9.71307 12.5075 8.69531 6.17103 numMergedOcc 0
27 mol 134 unq 4 iso 0 dist 6.49416 8.94367 8.80819 9.33094 12.3479 7.41373 5.41704 8.6355 8.79571 11.7151 6.81259 12.5075 9.86662 8.69531 6.17103 numMergedOcc 0
28 mol 134 unq 5 iso 0 dist 6.49416 6.37586 5.00817 9.33094 12.3479 10.8635 5.41704 8.6355 5.42582 11.7151 6.81259 12.5075 9.71307 8.69531 6.17103 numMergedOcc 0
29 mol 134 unq 6 iso 0 dist 9.86662 9.71307 5.49782 9.1998 12.8086 15.0225 6.17103 8.79571 5.42582 14.0978 11.6064 15.281 15.6507 6.42772 14.8449 numMergedOcc 0
30 mol 134 unq 7 iso 0 dist 9.86662 9.71307 5.49782 9.1998 12.8086 15.0225 6.17103 8.79571 5.42582 14.0978 7.09823 14.0375 15.9508 8.70621 13.0122 numMergedOcc 0
31 mol 134 unq 8 iso 0 dist 9.86662 9.71307 5.49782 8.69531 7.41373 10.8635 6.17103 8.79571 5.42582 11.7151 6.81259 8.94367 6.37586 9.33094 5.41704 numMergedOcc 0
32 mol 134 unq 9 iso 0 dist 9.71307 9.86662 5.49782 9.1998 15.0225 12.8086 6.17103 5.42582 8.79571 14.0978 11.6064 15.6507 15.281 6.42772 14.8449 numMergedOcc 0
33 mol 134 unq 10 iso 0 dist 9.71307 9.86662 5.49782 9.1998 15.0225 12.8086 6.17103 5.42582 8.79571 14.0978 7.09823 15.9508 14.0375 8.70621 13.0122 numMergedOcc 0
34 mol 134 unq 11 iso 0 dist 9.71307 9.86662 5.49782 8.69531 10.8635 7.41373 6.17103 5.42582 8.79571 11.7151 6.81259 6.37586 8.94367 9.33094 5.41704 numMergedOcc 0
35 mol 152 unq 0 iso 0 dist 6.70283 5.87555 5.42328 6.70693 5.39112 4.94983 8.25411 9.13561 12.4808 10.5081 7.65448 8.56324 10.399 6.59889 5.99333 numMergedOcc 0
36 mol 152 unq 1 iso 0 dist 6.70283 8.67331 6.4896 6.70693 5.39112 9.67475 8.25411 9.13561 14.1119 10.5081 7.65448 8.56324 14.1618 6.59889 5.99333 numMergedOcc 0
37 mol 181 unq 0 iso 0 dist 9.1374 8.03334 13.2049 9.76212 12.9532 6.50233 6.25083 6.94688 12.1309 14.5897 6.01247 9.94371 10.9639 8.59874 10.5753 numMergedOcc 0
38 mol 181 unq 1 iso 0 dist 9.1374 8.03334 13.2049 9.76212 12.9532 6.50233 4.77278 6.71012 12.2058 12.3788 6.01247 9.94371 10.9639 8.59874 5.88819 numMergedOcc 0
39 mol 181 unq 2 iso 0 dist 7.81386 7.63312 8.85576 9.01624 5.71898 5.93724 6.7991 4.93785 10.1232 6.76746 11.5866 9.81747 9.11469 5.05973 8.35755 numMergedOcc 0
40 mol 181 unq 3 iso 0 dist 7.63312 7.81386 8.85576 9.01624 5.93724 5.71898 4.80231 6.93764 11.4148 10.1634 11.5866 9.11469 9.81747 5.05973 11.4616 numMergedOcc 0
41 mol 224 unq 0 iso 0 dist 6.57273 6.60589 5.0744 8.79428 7.05804 5.76843 7.12232 6.87664 10.8259 10.8888 6.77699 10.103 6.65832 6.99769 12.6949 numMergedOcc 0
42 mol 224 unq 1 iso 0 dist 6.57273 6.60589 5.0744 8.79428 7.05804 5.76843 7.12232 6.87664 10.8259 10.8888 8.49799 5.78342 9.16166 6.8692 5.3621 numMergedOcc 0
43 mol 224 unq 2 iso 0 dist 5.78342 9.16166 5.0744 6.8692 7.05804 5.76843 5.3621 6.87664 10.8259 10.8888 11.328 10.103 6.65832 6.99769 12.6949 numMergedOcc 0
44 mol 224 unq 3 iso 0 dist 5.78342 9.16166 5.0744 6.8692 7.05804 5.76843 5.3621 6.87664 10.8259 10.8888 8.49799 6.57273 6.60589 8.79428 7.12232 numMergedOcc 0
45 mol 224 unq 4 iso 0 dist 5.78342 5.81334 5.60236 6.8692 7.05804 4.54188 5.3621 6.87664 10.2775 10.8888 11.328 10.103 10.9745 6.99769 12.6949 numMergedOcc 0
46 mol 224 unq 5 iso 0 dist 5.78342 5.81334 5.60236 6.8692 7.05804 4.54188 5.3621 6.87664 10.2775 10.8888 8.49799 6.57273 10.5128 8.79428 7.12232 numMergedOcc 0
47 mol 238 unq 0 iso 0 dist 6.22714 7.31233 5.34096 9.08509 12.7938 11.0772 5.17471 7.49471 7.19008 5.43613 10.1813 11.0896 11.5794 6.99888 5.54325 numMergedOcc 0
48 mol 238 unq 1 iso 0 dist 7.31233 6.22714 5.34096 9.08509 11.0772 12.7938 10.4664 6.55759 10.5202 14.4363 10.1813 11.5794 11.0896 6.99888 17.2608 numMergedOcc 0
49 mol 238 unq 2 iso 0 dist 7.31233 6.22714 5.34096 9.08509 11.0772 12.7938 11.2717 7.02475 12.1784 10.529 10.1813 11.5794 11.0896 6.99888 14.2685 numMergedOcc 0
50 mol 238 unq 3 iso 0 dist 7.31233 6.22714 5.34096 9.08509 11.0772 12.7938 12.6986 7.67322 12.1937 9.99105 10.1813 11.5794 11.0896 6.99888 11.6239 numMergedOcc 0
51 mol 238 unq 4 iso 0 dist 7.31233 6.22714 5.34096 9.08509 11.0772 12.7938 5.17471 7.19008 7.49471 5.43613 10.1813 11.5794 11.0896 6.99888 5.54325 numMergedOcc 0
52 mol 259 unq 0 iso 0 dist 7.88519 8.13497 4.69778 9.46361 11.6988 12.2293 11.6195 7.48005 10.9591 9.43105 6.96053 7.46176 10.3935 6.95511 5.79468 numMergedOcc 0
