0 mol 8 unq 0 iso 0 dist 6.82379 11.0223 5.00267 4.94497 8.77457 11.1833 9.88063 5.02333 7.8922 12.2927 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 6.24978 6.80407 5.00267 5.61772 8.77457 11.1833 11.0287 5.02333 7.8922 12.2927 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 9.66439 8.44094 5.00267 10.4848 8.77457 11.1833 14.5532 5.02333 7.8922 12.2927 numMergedOcc 0
3 mol 8 unq 3 iso 0 dist 7.3915 6.32152 5.00267 14.1378 8.77457 11.1833 10.5239 5.02333 7.8922 12.2927 numMergedOcc 0
4 mol 9 unq 0 iso 0 dist 7.05346 6.119 5.55437 8.50424 8.076 7.28672 15.1483 11.0722 9.78006 9.62394 numMergedOcc 0
5 mol 24 unq 0 iso 0 dist 6.60423 6.58998 9.38831 4.32034 9.69752 10.025 8.86116 5.97304 6.72502 12.9284 numMergedOcc 0
6 mol 24 unq 1 iso 0 dist 6.60423 6.58998 9.38831 8.52463 9.36461 6.99746 8.86116 5.97304 6.72502 8.60554 numMergedOcc 0
7 mol 24 unq 2 iso 0 dist 7.83786 11.0493 9.38831 9.6469 9.69752 10.025 10.5273 5.97304 6.72502 12.9284 numMergedOcc 0
8 mol 24 unq 3 iso 0 dist 7.83786 11.0493 9.38831 14.6654 9.36461 6.99746 10.5273 5.97304 6.72502 8.60554 numMergedOcc 0
9 mol 24 unq 4 iso 0 dist 4.93188 9.48345 9.40479 5.11617 4.90592 6.99746 13.2433 11.2106 6.72502 8.60554 numMergedOcc 0
10 mol 24 unq 5 iso 0 dist 4.93188 9.48345 9.40479 10.8238 8.16324 7.05541 13.2433 11.2106 6.72502 9.44691 numMergedOcc 0
11 mol 24 unq 6 iso 0 dist 9.24958 13.1456 9.40479 13.2229 4.90592 6.99746 15.5296 11.2106 6.72502 8.60554 numMergedOcc 0
12 mol 24 unq 7 iso 0 dist 9.24958 13.1456 9.40479 6.7828 8.16324 7.05541 15.5296 11.2106 6.72502 9.44691 numMergedOcc 0
13 mol 115 unq 0 iso 0 dist 5.74857 7.3094 8.71286 5.22052 8.85881 9.18958 7.88312 7.21418 5.72642 12.13 numMergedOcc 0
14 mol 119 unq 0 iso 0 dist 7.77116 4.91132 8.03035 7.20179 8.8562 6.96805 10.3704 4.99056 7.99857 9.11344 numMergedOcc 0
15 mol 119 unq 1 iso 0 dist 7.77116 4.91132 8.03035 7.20179 8.8562 6.96805 8.73993 3.78311 8.56342 6.52773 numMergedOcc 0
16 mol 119 unq 2 iso 0 dist 7.77116 4.91132 8.03035 9.89358 7.91683 13.3975 10.3704 4.99056 7.99857 12.7677 numMergedOcc 0
17 mol 119 unq 3 iso 0 dist 7.77116 4.91132 8.03035 9.89358 7.91683 13.3975 8.73993 3.78311 8.56342 9.23858 numMergedOcc 0
18 mol 119 unq 4 iso 0 dist 7.77116 6.08167 7.6968 7.20179 8.8562 4.86811 8.73993 3.78311 6.37542 6.52773 numMergedOcc 0
19 mol 119 unq 5 iso 0 dist 7.77116 6.08167 7.6968 9.89358 7.91683 8.00229 8.73993 3.78311 6.37542 9.23858 numMergedOcc 0
20 mol 156 unq 0 iso 0 dist 5.38091 6.44255 5.90883 5.81563 7.46845 11.3995 8.34702 10.7023 9.43259 13.0658 numMergedOcc 0
21 mol 156 unq 1 iso 0 dist 5.38091 5.82636 8.06913 5.81563 7.46845 11.6326 13.584 13.6634 9.31851 18.6707 numMergedOcc 0
22 mol 156 unq 2 iso 0 dist 5.38091 5.82636 8.06913 5.81563 7.46845 11.6326 8.34702 10.7023 6.2319 13.0658 numMergedOcc 0
23 mol 156 unq 3 iso 0 dist 5.38091 5.82636 8.06913 5.81563 7.46845 11.6326 9.06726 9.00862 9.97732 11.5017 numMergedOcc 0
24 mol 175 unq 0 iso 0 dist 8.0154 12.3408 7.32419 6.29885 8.05247 11.2348 9.29945 4.24624 5.4969 10.7017 numMergedOcc 0
25 mol 175 unq 1 iso 0 dist 8.0154 12.3408 7.32419 7.27408 9.71028 8.94702 9.29945 4.24624 5.4969 9.39352 numMergedOcc 0
26 mol 175 unq 2 iso 0 dist 8.0154 8.68081 8.31961 6.29885 8.05247 9.23758 9.29945 4.24624 6.4318 10.7017 numMergedOcc 0
27 mol 175 unq 3 iso 0 dist 8.0154 8.68081 8.31961 7.27408 9.71028 4.06277 9.29945 4.24624 6.4318 9.39352 numMergedOcc 0
28 mol 186 unq 0 iso 0 dist 9.56197 9.27818 7.55358 9.74148 7.46987 13.1254 16.1971 12.7155 7.20574 19.5202 numMergedOcc 0
29 mol 186 unq 1 iso 0 dist 9.56197 9.27818 7.55358 9.74148 7.46987 13.1254 15.6447 9.97575 6.85302 16.2017 numMergedOcc 0
30 mol 186 unq 2 iso 0 dist 9.56197 9.55926 7.60991 9.74148 7.46987 8.74186 15.6447 9.97575 9.98215 16.2017 numMergedOcc 0
31 mol 186 unq 3 iso 0 dist 7.24795 13.0197 7.55358 7.30024 7.46987 13.1254 18.5854 12.7155 7.20574 19.5202 numMergedOcc 0
32 mol 186 unq 4 iso 0 dist 7.24795 13.0197 7.55358 7.30024 7.46987 13.1254 16.9992 9.97575 6.85302 16.2017 numMergedOcc 0
33 mol 186 unq 5 iso 0 dist 7.24795 12.9082 7.60991 7.30024 7.46987 8.74186 16.9992 9.97575 9.98215 16.2017 numMergedOcc 0
34 mol 186 unq 6 iso 0 dist 8.64409 4.37002 7.55358 11.6919 7.46987 13.1254 10.7914 12.7155 7.20574 19.5202 numMergedOcc 0
35 mol 186 unq 7 iso 0 dist 8.64409 4.37002 7.55358 11.6919 7.46987 13.1254 9.09754 9.97575 6.85302 16.2017 numMergedOcc 0
36 mol 186 unq 8 iso 0 dist 8.64409 4.64235 7.60991 11.6919 7.46987 8.74186 9.09754 9.97575 9.98215 16.2017 numMergedOcc 0
37 mol 186 unq 9 iso 0 dist 7.60202 9.72941 7.55358 5.3967 7.46987 13.1254 16.7729 12.7155 7.20574 19.5202 numMergedOcc 0
38 mol 186 unq 10 iso 0 dist 7.60202 9.72941 7.55358 5.3967 7.46987 13.1254 14.1487 9.97575 6.85302 16.2017 numMergedOcc 0
39 mol 186 unq 11 iso 0 dist 7.60202 5.39885 7.60991 5.3967 7.46987 8.74186 14.1487 9.97575 9.98215 16.2017 numMergedOcc 0
40 mol 225 unq 0 iso 0 dist 6.6561 4.76151 6.53728 7.17211 8.20162 6.59663 13.3684 11.5135 8.87609 10.281 numMergedOcc 0
41 mol 225 unq 1 iso 0 dist 8.87609 11.5135 6.53728 5.76292 9.23935 14.3973 13.3684 4.76151 6.6561 13.45 numMergedOcc 0
42 mol 225 unq 2 iso 0 dist 8.87609 11.5135 6.53728 8.21235 7.77552 13.923 13.3684 4.76151 6.6561 11.7017 numMergedOcc 0
43 mol 252 unq 0 iso 0 dist 6.86945 7.63376 8.55481 6.35641 7.39391 12.0545 10.5136 6.28227 6.53679 12.9597 numMergedOcc 0
44 mol 252 unq 1 iso 0 dist 6.86945 7.63376 8.55481 6.35641 7.39391 12.0545 7.19638 5.25252 7.50201 11.0831 numMergedOcc 0
45 mol 258 unq 0 iso 0 dist 6.70815 6.6525 6.47194 10.8558 9.91199 8.09074 6.60405 7.42673 9.53063 15.8417 numMergedOcc 0
46 mol 258 unq 1 iso 0 dist 7.99477 5.27959 6.47194 13.2927 9.91199 8.09074 6.42289 7.42673 9.53063 15.8417 numMergedOcc 0
47 mol 264 unq 0 iso 0 dist 6.04162 6.84156 5.74568 6.26382 7.21655 11.5512 10.4298 4.48907 7.52281 11.0482 numMergedOcc 0
48 mol 264 unq 1 iso 0 dist 6.04162 6.84156 5.74568 6.26382 7.21655 11.5512 12.864 10.1591 6.42588 17.025 numMergedOcc 0
49 mol 264 unq 2 iso 0 dist 6.14323 9.37297 5.74568 5.24812 7.21655 11.5512 9.90113 4.48907 7.52281 11.0482 numMergedOcc 0
50 mol 264 unq 3 iso 0 dist 6.14323 9.37297 5.74568 5.24812 7.21655 11.5512 13.9815 10.1591 6.42588 17.025 numMergedOcc 0
