0 mol 8 unq 0 iso 0 dist 8.33604 7.3915 11.705 12.4076 17.5554 6.82379 14.1378 20.3264 8.77457 4.94497 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 8.33604 7.3915 11.705 9.22548 16.3913 6.24978 14.1378 20.3264 8.77457 5.61772 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 8.33604 7.3915 11.705 7.96511 16.2553 9.66439 14.1378 20.3264 8.77457 10.4848 numMergedOcc 0
3 mol 9 unq 0 iso 0 dist 9.87449 7.032 6.93413 5.06358 12.9221 7.9944 4.98827 11.621 6.32226 6.02809 numMergedOcc 0
4 mol 19 unq 0 iso 0 dist 8.78293 6.92532 15.1136 10.8007 19.07 7.48847 4.97119 13.1234 6.39966 6.42867 numMergedOcc 0
5 mol 19 unq 1 iso 0 dist 8.78293 6.92532 15.1136 5.03957 12.6444 6.36455 4.97119 13.1234 6.39966 6.01808 numMergedOcc 0
6 mol 19 unq 2 iso 0 dist 8.23643 6.92532 6.87842 10.8007 14.2119 7.48847 4.97119 11.3136 6.39966 6.42867 numMergedOcc 0
7 mol 19 unq 3 iso 0 dist 8.23643 6.92532 6.87842 5.03957 8.73972 6.36455 4.97119 11.3136 6.39966 6.01808 numMergedOcc 0
8 mol 19 unq 4 iso 0 dist 8.73972 6.36455 6.87842 10.6598 14.2119 7.48847 6.01808 11.3136 6.39966 6.42867 numMergedOcc 0
9 mol 19 unq 5 iso 0 dist 8.73972 6.36455 6.87842 5.03957 8.23643 6.92532 6.01808 11.3136 6.39966 4.97119 numMergedOcc 0
10 mol 19 unq 6 iso 0 dist 6.00439 7.48847 6.34272 10.8007 7.82528 6.92532 6.42867 5.82366 6.39966 4.97119 numMergedOcc 0
11 mol 19 unq 7 iso 0 dist 6.00439 7.48847 6.34272 10.6598 10.2708 6.36455 6.42867 5.82366 6.39966 6.01808 numMergedOcc 0
12 mol 19 unq 8 iso 0 dist 7.82528 6.92532 6.34272 10.8007 6.00439 7.48847 4.97119 5.82366 6.39966 6.42867 numMergedOcc 0
13 mol 19 unq 9 iso 0 dist 7.82528 6.92532 6.34272 5.03957 10.2708 6.36455 4.97119 5.82366 6.39966 6.01808 numMergedOcc 0
14 mol 73 unq 0 iso 0 dist 8.70133 7.04044 11.2505 5.4148 4.65521 8.73253 5.11416 7.10439 6.48232 6.56633 numMergedOcc 0
15 mol 73 unq 1 iso 0 dist 4.65521 8.73253 11.2505 5.4148 8.70133 7.04044 6.56633 7.10439 6.48232 5.11416 numMergedOcc 0
16 mol 85 unq 0 iso 0 dist 9.47876 7.1589 12.5072 4.26409 13.6587 8.00777 9.29301 10.0297 8.70863 11.165 numMergedOcc 0
17 mol 131 unq 0 iso 0 dist 8.6243 8.71039 8.15392 5.55373 12.5969 8.86329 7.92788 10.7802 8.92828 10.3369 numMergedOcc 0
18 mol 131 unq 1 iso 0 dist 8.6243 8.71039 8.15392 5.55373 12.5969 8.86329 8.23791 11.4282 5.56627 7.7567 numMergedOcc 0
19 mol 131 unq 2 iso 0 dist 8.6243 6.92648 6.01893 7.58238 14.1661 9.15431 7.92788 10.7802 5.44303 6.51918 numMergedOcc 0
20 mol 131 unq 3 iso 0 dist 8.6243 6.92648 6.01893 7.58238 14.1661 9.15431 8.23791 11.4282 8.50562 9.60968 numMergedOcc 0
21 mol 131 unq 4 iso 0 dist 8.6243 6.92648 6.01893 6.63273 6.91348 9.29384 7.92788 10.7802 5.44303 13.1439 numMergedOcc 0
22 mol 131 unq 5 iso 0 dist 8.6243 6.92648 6.01893 6.63273 6.91348 9.29384 8.23791 11.4282 8.50562 13.7237 numMergedOcc 0
23 mol 131 unq 6 iso 0 dist 6.91348 9.29384 6.01893 13.2572 14.1661 9.15431 13.1439 10.7802 5.44303 6.51918 numMergedOcc 0
24 mol 131 unq 7 iso 0 dist 6.91348 9.29384 6.01893 13.2572 14.1661 9.15431 13.7237 11.4282 8.50562 9.60968 numMergedOcc 0
25 mol 131 unq 8 iso 0 dist 6.91348 9.29384 6.01893 6.63273 8.6243 6.92648 13.1439 10.7802 5.44303 7.92788 numMergedOcc 0
26 mol 131 unq 9 iso 0 dist 6.91348 9.29384 6.01893 6.63273 8.6243 6.92648 13.7237 11.4282 8.50562 8.23791 numMergedOcc 0
27 mol 131 unq 10 iso 0 dist 9.51418 9.29384 15.1974 13.2572 20.4785 9.15431 13.1439 18.4174 5.44303 6.51918 numMergedOcc 0
28 mol 131 unq 11 iso 0 dist 9.51418 9.29384 15.1974 13.2572 20.4785 9.15431 13.7237 16.3398 8.50562 9.60968 numMergedOcc 0
29 mol 131 unq 12 iso 0 dist 9.51418 9.29384 15.1974 6.63273 12.9472 6.92648 13.1439 18.4174 5.44303 7.92788 numMergedOcc 0
30 mol 131 unq 13 iso 0 dist 9.51418 9.29384 15.1974 6.63273 12.9472 6.92648 13.7237 16.3398 8.50562 8.23791 numMergedOcc 0
31 mol 134 unq 0 iso 0 dist 8.79571 8.20836 9.65798 5.62899 13.0121 7.36779 4.57832 8.73604 9.30061 7.1797 numMergedOcc 0
32 mol 141 unq 0 iso 0 dist 6.93652 6.69515 8.00633 6.21253 11.8898 7.86572 10.1386 9.40594 4.46777 10.1432 numMergedOcc 0
33 mol 141 unq 1 iso 0 dist 6.93652 6.69515 8.00633 6.21253 11.8898 7.86572 7.42649 5.26989 6.94988 9.43674 numMergedOcc 0
34 mol 181 unq 0 iso 0 dist 6.94688 6.51749 10.4684 10.1912 14.4632 7.20392 5.6044 10.3766 7.11785 12.9468 numMergedOcc 0
35 mol 181 unq 1 iso 0 dist 6.71012 6.51749 12.69 10.1912 15.4777 7.20392 5.6044 10.7723 7.11785 12.9468 numMergedOcc 0
36 mol 194 unq 0 iso 0 dist 6.47873 6.26839 6.8278 8.0179 11.6993 8.12346 11.6598 11.4415 5.68348 12.0887 numMergedOcc 0
37 mol 194 unq 1 iso 0 dist 6.47873 6.26839 6.8278 14.6506 11.9484 8.83356 11.6598 11.4415 5.68348 7.11753 numMergedOcc 0
38 mol 194 unq 2 iso 0 dist 6.47873 6.26839 6.8278 8.48054 8.38695 8.2654 11.6598 11.4415 5.68348 12.8755 numMergedOcc 0
39 mol 194 unq 3 iso 0 dist 5.48258 8.83356 7.69247 14.6506 12.1599 6.26839 7.11753 8.52969 5.68348 11.6598 numMergedOcc 0
40 mol 194 unq 4 iso 0 dist 5.48258 8.83356 7.69247 13.5632 13.8412 8.12346 7.11753 8.52969 5.68348 12.0887 numMergedOcc 0
41 mol 194 unq 5 iso 0 dist 5.48258 8.83356 7.69247 11.6097 10.3975 8.2654 7.11753 8.52969 5.68348 12.8755 numMergedOcc 0
42 mol 194 unq 6 iso 0 dist 6.15769 8.83356 13.9521 14.6506 18.923 6.26839 7.11753 12.9874 5.68348 11.6598 numMergedOcc 0
43 mol 194 unq 7 iso 0 dist 6.15769 8.83356 13.9521 13.5632 18.1875 8.12346 7.11753 12.9874 5.68348 12.0887 numMergedOcc 0
44 mol 194 unq 8 iso 0 dist 6.15769 8.83356 13.9521 11.6097 14.4527 8.2654 7.11753 12.9874 5.68348 12.8755 numMergedOcc 0
45 mol 194 unq 9 iso 0 dist 8.38695 8.2654 6.8278 8.48054 6.47873 6.26839 12.8755 11.4415 5.68348 11.6598 numMergedOcc 0
46 mol 194 unq 10 iso 0 dist 8.38695 8.2654 6.8278 6.26298 11.6993 8.12346 12.8755 11.4415 5.68348 12.0887 numMergedOcc 0
47 mol 194 unq 11 iso 0 dist 8.38695 8.2654 6.8278 11.6097 11.9484 8.83356 12.8755 11.4415 5.68348 7.11753 numMergedOcc 0
48 mol 218 unq 0 iso 0 dist 8.53199 5.76954 8.21424 4.72474 12.0819 6.29367 7.84019 12.6212 8.3087 4.92618 numMergedOcc 0
49 mol 218 unq 1 iso 0 dist 8.53199 5.76954 8.21424 5.61978 13.6555 9.20961 7.84019 12.6212 8.3087 10.9043 numMergedOcc 0
50 mol 218 unq 2 iso 0 dist 8.53199 6.29511 10.1198 4.72474 12.0819 8.86175 7.84019 12.6212 9.32945 4.92618 numMergedOcc 0
