0 mol 7 unq 0 iso 0 dist 5.72491 8.72114 10.1959 10.789 9.55056 13.6379 7.10621 5.44992 13.8829 7.31201 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.72491 8.72114 10.1959 10.515 7.45262 9.97624 10.5461 10.2446 5.03847 6.36911 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 5.72491 8.72114 10.1959 10.515 7.45262 9.97624 7.10621 5.44992 13.8829 9.36807 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.88043 5.99972 7.25346 12.2708 9.55056 15.5696 12.2333 5.44992 12.4827 7.31201 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 7.88043 5.99972 7.25346 6.06176 7.45262 10.6471 8.41585 10.2446 12.0193 6.36911 numMergedOcc 0
5 mol 7 unq 5 iso 0 dist 7.88043 5.99972 7.25346 6.06176 7.45262 10.6471 12.2333 5.44992 12.4827 9.36807 numMergedOcc 0
6 mol 7 unq 6 iso 0 dist 8.80762 5.99972 10.0658 12.2708 7.57354 15.5696 12.2333 4.74523 12.4827 7.31201 numMergedOcc 0
7 mol 7 unq 7 iso 0 dist 8.80762 5.99972 10.0658 6.06176 6.96586 10.6471 8.41585 12.3097 12.0193 6.36911 numMergedOcc 0
8 mol 7 unq 8 iso 0 dist 8.80762 5.99972 10.0658 6.06176 6.96586 10.6471 12.2333 4.74523 12.4827 9.36807 numMergedOcc 0
9 mol 8 unq 0 iso 0 dist 6.82379 7.03958 5.65816 13.7792 8.94096 14.4294 9.88063 5.02333 7.43522 8.99126 numMergedOcc 0
10 mol 8 unq 1 iso 0 dist 7.3915 8.53529 5.65816 12.8924 8.94096 14.4294 10.5239 5.02333 7.43522 8.99126 numMergedOcc 0
11 mol 9 unq 0 iso 0 dist 7.05346 7.32257 8.88528 13.5628 9.82483 11.6997 15.1483 11.0722 16.147 6.33889 numMergedOcc 0
12 mol 9 unq 1 iso 0 dist 9.78006 9.62394 7.28672 5.60154 8.04924 9.57198 8.57077 3.98483 9.5997 8.47421 numMergedOcc 0
13 mol 24 unq 0 iso 0 dist 6.60423 9.41441 11.9395 5.39241 8.62284 13.2857 6.86014 6.00575 6.66749 9.75144 numMergedOcc 0
14 mol 119 unq 0 iso 0 dist 7.99857 9.11344 6.96805 6.35763 9.87025 11.1099 9.87172 7.61939 10.9441 6.19042 numMergedOcc 0
15 mol 119 unq 1 iso 0 dist 7.99857 9.11344 6.96805 6.35763 9.87025 11.1099 10.1813 10.326 6.42402 8.43904 numMergedOcc 0
16 mol 119 unq 2 iso 0 dist 7.99857 9.11344 6.96805 7.36192 5.85818 11.8717 14.5183 9.3046 16.2264 7.39889 numMergedOcc 0
17 mol 119 unq 3 iso 0 dist 7.99857 9.11344 6.96805 7.36192 5.85818 11.8717 10.3704 4.91132 7.20179 9.63176 numMergedOcc 0
18 mol 119 unq 4 iso 0 dist 7.99857 9.11344 6.96805 7.36192 5.85818 11.8717 9.87172 7.61939 10.9441 7.44174 numMergedOcc 0
19 mol 119 unq 5 iso 0 dist 8.56342 6.52773 6.96805 10.0197 9.87025 11.1099 12.6489 7.61939 10.9441 6.19042 numMergedOcc 0
20 mol 119 unq 6 iso 0 dist 8.56342 6.52773 6.96805 10.0197 9.87025 11.1099 9.72413 10.326 6.42402 8.43904 numMergedOcc 0
21 mol 119 unq 7 iso 0 dist 8.56342 6.52773 6.96805 10.6679 5.85818 11.8717 16.7981 9.3046 16.2264 7.39889 numMergedOcc 0
22 mol 119 unq 8 iso 0 dist 8.56342 6.52773 6.96805 10.6679 5.85818 11.8717 8.73993 4.91132 7.20179 9.63176 numMergedOcc 0
23 mol 119 unq 9 iso 0 dist 8.56342 6.52773 6.96805 10.6679 5.85818 11.8717 12.6489 7.61939 10.9441 7.44174 numMergedOcc 0
24 mol 119 unq 10 iso 0 dist 8.56342 9.23858 13.3975 10.0197 9.87025 18.7646 12.6489 7.61939 20.1288 6.19042 numMergedOcc 0
25 mol 119 unq 11 iso 0 dist 8.56342 9.23858 13.3975 10.0197 9.87025 18.7646 9.72413 10.326 17.9302 8.43904 numMergedOcc 0
26 mol 119 unq 12 iso 0 dist 8.56342 9.23858 13.3975 10.6679 5.85818 15.8603 16.7981 9.3046 19.552 7.39889 numMergedOcc 0
27 mol 119 unq 13 iso 0 dist 8.56342 9.23858 13.3975 10.6679 5.85818 15.8603 8.73993 4.91132 9.89358 9.63176 numMergedOcc 0
28 mol 119 unq 14 iso 0 dist 8.56342 9.23858 13.3975 10.6679 5.85818 15.8603 12.6489 7.61939 20.1288 7.44174 numMergedOcc 0
29 mol 143 unq 0 iso 0 dist 7.63338 7.78652 11.5146 6.01455 8.1582 6.46089 10.6877 6.41287 10.0059 7.31468 numMergedOcc 0
30 mol 143 unq 1 iso 0 dist 7.63338 7.78652 11.5146 6.01455 8.1582 6.46089 12.7524 11.488 8.57817 7.7056 numMergedOcc 0
31 mol 143 unq 2 iso 0 dist 7.63338 8.91301 13.434 6.01455 8.1582 10.1154 10.6877 6.41287 13.1639 7.31468 numMergedOcc 0
32 mol 143 unq 3 iso 0 dist 7.63338 8.91301 13.434 6.01455 8.1582 10.1154 12.7524 11.488 12.4341 7.7056 numMergedOcc 0
33 mol 143 unq 4 iso 0 dist 7.25673 7.78652 6.60479 6.01455 7.88655 6.46089 10.6877 7.11704 10.0059 7.31468 numMergedOcc 0
34 mol 143 unq 5 iso 0 dist 7.25673 7.78652 6.60479 6.01455 7.88655 6.46089 12.7524 9.53139 8.57817 7.7056 numMergedOcc 0
35 mol 143 unq 6 iso 0 dist 7.25673 8.91301 7.54337 6.01455 7.88655 10.1154 10.6877 7.11704 13.1639 7.31468 numMergedOcc 0
36 mol 143 unq 7 iso 0 dist 7.25673 8.91301 7.54337 6.01455 7.88655 10.1154 12.7524 9.53139 12.4341 7.7056 numMergedOcc 0
37 mol 156 unq 0 iso 0 dist 7.73169 7.30357 8.40261 5.07967 7.04913 7.30946 10.2717 7.7635 6.14767 6.88137 numMergedOcc 0
38 mol 156 unq 1 iso 0 dist 7.73169 8.61587 12.8796 5.07967 7.04913 11.3161 10.2717 7.7635 12.212 6.88137 numMergedOcc 0
39 mol 175 unq 0 iso 0 dist 7.35824 9.39352 10.3786 11.1651 7.01126 16.3661 19.63 13.9336 21.8682 9.31887 numMergedOcc 0
40 mol 175 unq 1 iso 0 dist 9.17364 9.39352 11.9672 11.1651 6.58434 16.3661 19.63 11.873 21.8682 9.31887 numMergedOcc 0
41 mol 181 unq 0 iso 0 dist 6.51749 8.90963 13.0913 5.4601 7.345 13.6646 5.98885 5.93488 9.81073 7.20046 numMergedOcc 0
42 mol 181 unq 1 iso 0 dist 6.51749 8.90963 13.0913 10.0524 9.52987 15.9219 5.98885 5.93488 9.81073 7.13543 numMergedOcc 0
43 mol 188 unq 0 iso 0 dist 8.57261 7.14503 5.0782 12.0548 7.48284 11.4648 13.353 5.48276 8.77113 6.90541 numMergedOcc 0
44 mol 188 unq 1 iso 0 dist 8.57261 8.10214 5.87427 12.0548 7.48284 9.33696 13.353 5.48276 10.5721 6.90541 numMergedOcc 0
45 mol 192 unq 0 iso 0 dist 7.24199 8.77999 3.86183 5.71262 8.53433 7.33225 5.59424 7.0057 8.49529 8.36822 numMergedOcc 0
46 mol 198 unq 0 iso 0 dist 8.10985 6.34616 9.86517 12.2117 8.15936 16.7877 13.7844 6.74772 15.6566 7.90031 numMergedOcc 0
47 mol 198 unq 1 iso 0 dist 8.10985 6.34616 9.86517 10.8191 8.16598 15.2254 13.7844 6.74772 15.6566 7.21533 numMergedOcc 0
48 mol 205 unq 0 iso 0 dist 5.60393 5.44002 8.46033 6.23291 5.42696 10.5073 7.26832 5.28092 10.3603 9.19704 numMergedOcc 0
49 mol 227 unq 0 iso 0 dist 8.03442 7.43071 12.8075 6.43754 7.1372 12.2922 7.22101 10.5813 6.35849 8.17891 numMergedOcc 0
50 mol 227 unq 1 iso 0 dist 8.03442 7.43071 12.8075 6.43754 7.1372 12.2922 8.65997 7.22396 10.204 6.95902 numMergedOcc 0
51 mol 227 unq 2 iso 0 dist 8.03442 5.41321 4.59123 6.43754 7.1372 7.57454 7.22101 10.5813 10.9607 8.17891 numMergedOcc 0
52 mol 227 unq 3 iso 0 dist 8.03442 5.41321 4.59123 6.43754 7.1372 7.57454 8.65997 7.22396 9.72615 6.95902 numMergedOcc 0
53 mol 238 unq 0 iso 0 dist 5.52379 7.10685 5.83386 11.6239 7.61203 13.0987 11.5794 11.0349 16.0971 7.67322 numMergedOcc 0
54 mol 238 unq 1 iso 0 dist 5.52379 7.10685 5.83386 13.9614 9.47845 14.4678 10.0419 5.87253 6.54814 9.68513 numMergedOcc 0
55 mol 238 unq 2 iso 0 dist 5.52379 7.10685 5.83386 13.9614 9.47845 14.4678 12.2442 10.7551 14.388 9.29858 numMergedOcc 0
56 mol 238 unq 3 iso 0 dist 5.52379 7.10685 5.83386 12.3042 6.92409 10.6749 13.6591 10.7508 10.3871 9.90142 numMergedOcc 0
57 mol 238 unq 4 iso 0 dist 5.52379 7.10685 5.83386 12.3042 6.92409 10.6749 10.0419 5.87253 6.54814 5.9216 numMergedOcc 0
58 mol 238 unq 5 iso 0 dist 5.52379 7.10685 5.83386 5.54325 6.89694 10.1326 11.0896 13.0113 17.2411 7.49471 numMergedOcc 0
59 mol 238 unq 6 iso 0 dist 5.52379 7.10685 5.83386 5.54325 6.89694 10.1326 11.5794 11.0349 16.0971 7.19008 numMergedOcc 0
60 mol 259 unq 0 iso 0 dist 8.55558 7.08526 6.31909 5.79468 6.39918 8.71497 7.46176 5.60748 8.81835 7.48005 numMergedOcc 0
61 mol 259 unq 1 iso 0 dist 8.55558 7.08526 6.31909 5.79468 6.39918 8.71497 11.858 7.31951 8.75685 8.37865 numMergedOcc 0
