0 mol 7 unq 0 iso 0 dist 8.41585 7.88043 10.2446 12.2041 10.5461 5.72491 12.2708 10.672 9.55056 10.789 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.41585 7.88043 10.2446 12.2041 10.5461 5.72491 6.06176 6.36911 7.45262 10.515 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.10621 5.72491 5.44992 12.2041 12.2333 7.88043 10.789 7.31201 9.55056 12.2708 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.10621 5.72491 5.44992 12.2041 12.2333 7.88043 10.515 9.36807 7.45262 6.06176 numMergedOcc 0
4 mol 8 unq 0 iso 0 dist 8.96553 7.3915 7.43529 12.4076 10.9634 6.82379 12.8924 14.7292 8.94096 13.7792 numMergedOcc 0
5 mol 8 unq 1 iso 0 dist 8.96553 7.3915 7.43529 12.4076 10.9634 6.82379 4.85329 10.2611 9.07858 15.4959 numMergedOcc 0
6 mol 8 unq 2 iso 0 dist 8.96553 7.3915 7.43529 9.22548 12.9396 6.24978 12.8924 14.7292 8.94096 10.6893 numMergedOcc 0
7 mol 8 unq 3 iso 0 dist 8.96553 7.3915 7.43529 9.22548 12.9396 6.24978 4.85329 10.2611 9.07858 12.0818 numMergedOcc 0
8 mol 8 unq 4 iso 0 dist 8.96553 7.3915 7.43529 7.96511 14.7769 9.66439 12.8924 14.7292 8.94096 13.8882 numMergedOcc 0
9 mol 8 unq 5 iso 0 dist 8.96553 7.3915 7.43529 7.96511 14.7769 9.66439 4.85329 10.2611 9.07858 11.4738 numMergedOcc 0
10 mol 16 unq 0 iso 0 dist 7.63133 6.56335 10.454 5.5251 13.084 7.2668 6.73355 13.0191 7.40724 4.77289 numMergedOcc 0
11 mol 16 unq 1 iso 0 dist 5.46498 6.56335 6.70071 5.5251 9.80614 7.2668 6.73355 8.41862 7.40724 4.77289 numMergedOcc 0
12 mol 16 unq 2 iso 0 dist 8.71745 6.56335 4.50891 5.5251 10.2909 7.2668 6.73355 8.16785 7.40724 4.77289 numMergedOcc 0
13 mol 24 unq 0 iso 0 dist 6.86014 6.60423 6.00575 7.05502 11.573 7.83786 5.39241 9.75144 8.62284 4.51549 numMergedOcc 0
14 mol 24 unq 1 iso 0 dist 8.86116 6.60423 5.97304 7.05502 10.5273 7.83786 5.39241 12.4274 8.62284 4.51549 numMergedOcc 0
15 mol 26 unq 0 iso 0 dist 8.34347 5.69955 10.6756 9.78225 17.7357 8.6385 9.87119 17.2621 7.61055 4.74747 numMergedOcc 0
16 mol 94 unq 0 iso 0 dist 7.89459 9.97569 5.60279 7.49897 10.1664 8.16733 11.997 10.3578 5.18655 8.20144 numMergedOcc 0
17 mol 112 unq 0 iso 0 dist 7.71338 6.43433 8.56707 5.0812 12.603 9.92283 6.72991 11.6597 7.82011 8.57646 numMergedOcc 0
18 mol 112 unq 1 iso 0 dist 9.60462 9.92283 17.3924 5.0812 13.9874 6.43433 8.57646 17.7547 7.82011 6.72991 numMergedOcc 0
19 mol 119 unq 0 iso 0 dist 8.73993 8.56342 4.91132 4.85907 10.3704 7.99857 10.0197 14.0269 9.87025 6.35763 numMergedOcc 0
20 mol 119 unq 1 iso 0 dist 8.73993 8.56342 4.91132 4.85907 10.3704 7.99857 10.6679 9.63176 5.85818 7.36192 numMergedOcc 0
21 mol 119 unq 2 iso 0 dist 9.87172 7.99857 7.61939 4.85907 12.6489 8.56342 6.35763 6.19042 9.87025 10.0197 numMergedOcc 0
22 mol 119 unq 3 iso 0 dist 9.87172 7.99857 7.61939 4.85907 12.6489 8.56342 7.36192 7.44174 5.85818 10.6679 numMergedOcc 0
23 mol 131 unq 0 iso 0 dist 7.12972 6.92648 9.32969 7.58238 14.2958 9.15431 4.89973 11.0153 9.39683 7.71288 numMergedOcc 0
24 mol 131 unq 1 iso 0 dist 7.12972 6.92648 9.32969 6.63273 6.85062 9.29384 4.89973 11.0153 9.39683 7.00551 numMergedOcc 0
25 mol 131 unq 2 iso 0 dist 6.85062 9.29384 9.32969 13.2572 14.2958 9.15431 7.00551 11.0153 9.39683 7.71288 numMergedOcc 0
26 mol 131 unq 3 iso 0 dist 6.85062 9.29384 9.32969 6.63273 7.12972 6.92648 7.00551 11.0153 9.39683 4.89973 numMergedOcc 0
27 mol 156 unq 0 iso 0 dist 8.34702 6.2319 5.82636 7.14831 13.584 9.31851 13.2847 13.0488 9.54367 10.5873 numMergedOcc 0
28 mol 156 unq 1 iso 0 dist 8.34702 6.2319 5.82636 7.14831 13.584 9.31851 5.97294 10.0526 7.26859 4.73711 numMergedOcc 0
29 mol 156 unq 2 iso 0 dist 8.34702 6.2319 5.82636 6.31306 9.06726 9.97732 13.2847 13.0488 9.54367 14.42 numMergedOcc 0
30 mol 156 unq 3 iso 0 dist 8.34702 6.2319 5.82636 6.31306 9.06726 9.97732 5.97294 10.0526 7.26859 6.53729 numMergedOcc 0
31 mol 156 unq 4 iso 0 dist 9.06726 9.97732 5.82636 9.98789 13.584 9.31851 14.42 13.0488 9.54367 10.5873 numMergedOcc 0
32 mol 156 unq 5 iso 0 dist 9.06726 9.97732 5.82636 9.98789 13.584 9.31851 6.53729 10.0526 7.26859 4.73711 numMergedOcc 0
33 mol 156 unq 6 iso 0 dist 9.06726 9.97732 5.82636 6.31306 8.34702 6.2319 14.42 13.0488 9.54367 13.2847 numMergedOcc 0
34 mol 156 unq 7 iso 0 dist 9.06726 9.97732 5.82636 6.31306 8.34702 6.2319 6.53729 10.0526 7.26859 5.97294 numMergedOcc 0
35 mol 181 unq 0 iso 0 dist 9.1374 6.51749 13.8722 10.1912 15.0228 7.20392 5.4601 10.2276 7.345 6.14208 numMergedOcc 0
36 mol 181 unq 1 iso 0 dist 9.1374 6.51749 13.8722 10.1912 15.0228 7.20392 10.0524 10.7636 9.52987 5.95965 numMergedOcc 0
37 mol 181 unq 2 iso 0 dist 5.98885 6.51749 5.93488 10.1912 9.09537 7.20392 5.4601 7.20046 7.345 6.14208 numMergedOcc 0
38 mol 181 unq 3 iso 0 dist 5.98885 6.51749 5.93488 10.1912 9.09537 7.20392 10.0524 7.13543 9.52987 5.95965 numMergedOcc 0
39 mol 181 unq 4 iso 0 dist 9.09537 7.20392 5.93488 10.1912 5.98885 6.51749 6.14208 7.20046 7.345 5.4601 numMergedOcc 0
40 mol 181 unq 5 iso 0 dist 9.09537 7.20392 5.93488 10.1912 5.98885 6.51749 5.95965 7.13543 9.52987 10.0524 numMergedOcc 0
41 mol 181 unq 6 iso 0 dist 9.15386 6.51749 7.64267 10.1912 12.9862 7.20392 5.4601 11.968 7.345 6.14208 numMergedOcc 0
42 mol 181 unq 7 iso 0 dist 9.15386 6.51749 7.64267 10.1912 12.9862 7.20392 10.0524 11.8099 9.52987 5.95965 numMergedOcc 0
43 mol 205 unq 0 iso 0 dist 6.03031 8.44861 5.28092 7.38516 7.26832 5.60393 8.66809 9.19704 5.42696 6.23291 numMergedOcc 0
44 mol 205 unq 1 iso 0 dist 7.26832 5.60393 5.28092 7.38516 6.03031 8.44861 6.23291 9.19704 5.42696 8.66809 numMergedOcc 0
45 mol 214 unq 0 iso 0 dist 8.82096 8.46327 10.2399 12.7897 16.7691 7.05523 10.7373 12.3623 7.2498 7.62375 numMergedOcc 0
46 mol 227 unq 0 iso 0 dist 7.22101 8.38865 11.0628 5.22356 8.65997 5.4694 9.60993 12.9493 9.20589 5.34702 numMergedOcc 0
47 mol 227 unq 1 iso 0 dist 7.22101 8.38865 11.0628 5.22356 8.65997 5.4694 13.3557 12.3856 7.89801 8.8709 numMergedOcc 0
48 mol 227 unq 2 iso 0 dist 8.65997 5.4694 11.0628 5.22356 7.22101 8.38865 5.34702 12.9493 9.20589 9.60993 numMergedOcc 0
49 mol 227 unq 3 iso 0 dist 8.65997 5.4694 11.0628 5.22356 7.22101 8.38865 8.8709 12.3856 7.89801 13.3557 numMergedOcc 0
50 mol 227 unq 4 iso 0 dist 7.09863 8.38865 12.9587 5.22356 10.8157 5.4694 9.60993 15.4174 9.20589 5.34702 numMergedOcc 0
51 mol 227 unq 5 iso 0 dist 7.09863 8.38865 12.9587 5.22356 10.8157 5.4694 13.3557 16.1617 7.89801 8.8709 numMergedOcc 0
52 mol 238 unq 0 iso 0 dist 5.72887 7.32982 12.3808 10.0191 13.5431 6.66971 8.85181 13.9989 9.42618 13.0842 numMergedOcc 0
53 mol 238 unq 1 iso 0 dist 5.72887 7.32982 12.3808 10.1648 12.8711 6.4398 8.85181 13.9989 9.42618 15.3074 numMergedOcc 0
54 mol 238 unq 2 iso 0 dist 6.22714 5.64181 10.216 6.85126 12.6642 7.61393 10.4664 10.5202 8.6597 13.3539 numMergedOcc 0
55 mol 238 unq 3 iso 0 dist 6.22714 5.64181 10.216 6.85126 12.6642 7.61393 11.2717 12.1784 7.47235 14.7509 numMergedOcc 0
56 mol 238 unq 4 iso 0 dist 6.22714 5.64181 10.216 6.85126 12.6642 7.61393 5.17471 7.49471 6.44735 10.7999 numMergedOcc 0
57 mol 238 unq 5 iso 0 dist 6.22714 5.64181 10.216 6.85126 12.6642 7.61393 5.03393 10.9946 5.91208 5.49433 numMergedOcc 0
58 mol 238 unq 6 iso 0 dist 7.31233 5.64181 7.83352 6.85126 13.1583 7.61393 10.4664 6.55759 8.6597 13.3539 numMergedOcc 0
59 mol 238 unq 7 iso 0 dist 7.31233 5.64181 7.83352 6.85126 13.1583 7.61393 11.2717 7.02475 7.47235 14.7509 numMergedOcc 0
60 mol 238 unq 8 iso 0 dist 7.31233 5.64181 7.83352 6.85126 13.1583 7.61393 5.17471 7.19008 6.44735 10.7999 numMergedOcc 0
61 mol 238 unq 9 iso 0 dist 7.31233 5.64181 7.83352 6.85126 13.1583 7.61393 5.03393 11.3465 5.91208 5.49433 numMergedOcc 0
62 mol 248 unq 0 iso 0 dist 7.69895 6.17052 5.99459 5.55137 7.21521 9.77666 6.48757 6.07192 8.53148 5.51827 numMergedOcc 0
63 mol 248 unq 1 iso 0 dist 7.21521 9.77666 5.99459 5.55137 7.69895 6.17052 5.51827 6.07192 8.53148 6.48757 numMergedOcc 0
64 mol 252 unq 0 iso 0 dist 8.1148 8.47784 5.89666 13.2361 14.2744 8.66469 4.23801 7.66365 5.2361 9.12442 numMergedOcc 0
65 mol 252 unq 1 iso 0 dist 8.1148 8.47784 5.89666 13.2361 14.2744 8.66469 13.6996 10.765 5.57515 7.35945 numMergedOcc 0
66 mol 252 unq 2 iso 0 dist 8.1148 8.47784 5.89666 13.2361 14.2744 8.66469 15.4395 13.5038 8.28694 5.26003 numMergedOcc 0
67 mol 252 unq 3 iso 0 dist 8.1715 8.47784 10.672 13.2361 17.8419 8.66469 4.23801 10.165 5.2361 9.12442 numMergedOcc 0
68 mol 252 unq 4 iso 0 dist 8.1715 8.47784 10.672 13.2361 17.8419 8.66469 13.6996 15.0802 5.57515 7.35945 numMergedOcc 0
69 mol 252 unq 5 iso 0 dist 8.1715 8.47784 10.672 13.2361 17.8419 8.66469 15.4395 18.7608 8.28694 5.26003 numMergedOcc 0
70 mol 259 unq 0 iso 0 dist 7.46176 8.55558 5.60748 9.98105 12.0576 8.59697 5.79468 7.48005 6.39918 5.31048 numMergedOcc 0
71 mol 259 unq 1 iso 0 dist 5.30224 8.59697 7.31951 9.98105 11.858 8.55558 5.31048 8.37865 6.39918 5.79468 numMergedOcc 0
72 mol 261 unq 0 iso 0 dist 9.14619 5.26434 6.04016 7.00201 8.45658 8.60026 7.49174 7.47164 9.24121 5.22253 numMergedOcc 0
73 mol 261 unq 1 iso 0 dist 8.45658 8.60026 6.04016 7.00201 9.14619 5.26434 5.22253 7.47164 9.24121 7.49174 numMergedOcc 0
74 mol 264 unq 0 iso 0 dist 9.17653 6.14323 13.0621 4.92077 13.4025 6.04162 12.3807 21.0973 9.42738 8.16326 numMergedOcc 0
75 mol 272 unq 0 iso 0 dist 9.97651 9.64269 4.86504 6.6954 10.1698 6.88809 4.72202 6.16449 7.55161 8.5751 numMergedOcc 0
76 mol 272 unq 1 iso 0 dist 9.97651 9.64269 4.86504 8.12676 8.46116 8.46061 4.72202 6.16449 7.55161 8.52877 numMergedOcc 0
77 mol 272 unq 2 iso 0 dist 8.33638 8.46061 8.7909 8.12676 13.2494 9.64269 8.52877 10.1966 7.55161 4.72202 numMergedOcc 0
78 mol 272 unq 3 iso 0 dist 8.33638 8.46061 8.7909 7.34222 13.168 6.88809 8.52877 10.1966 7.55161 8.5751 numMergedOcc 0
79 mol 272 unq 4 iso 0 dist 8.46116 8.46061 4.86504 8.12676 9.97651 9.64269 8.52877 6.16449 7.55161 4.72202 numMergedOcc 0
80 mol 272 unq 5 iso 0 dist 8.46116 8.46061 4.86504 7.34222 10.1698 6.88809 8.52877 6.16449 7.55161 8.5751 numMergedOcc 0
