0 mol 8 unq 0 iso 0 dist 6.82379 7.03958 5.65816 6.94408 6.24978 9.77703 4.94497 8.77457 11.3039 5.61772 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 6.82379 7.03958 5.65816 11.2508 9.66439 12.013 4.94497 8.77457 11.3039 10.4848 numMergedOcc 0
2 mol 8 unq 2 iso 0 dist 6.82379 7.03958 5.65816 12.4076 7.3915 8.53529 4.94497 8.77457 11.3039 14.1378 numMergedOcc 0
3 mol 8 unq 3 iso 0 dist 7.3915 8.53529 5.65816 12.4076 6.82379 7.03958 14.1378 8.77457 11.3039 4.94497 numMergedOcc 0
4 mol 8 unq 4 iso 0 dist 7.3915 8.53529 5.65816 9.22548 6.24978 9.77703 14.1378 8.77457 11.3039 5.61772 numMergedOcc 0
5 mol 8 unq 5 iso 0 dist 7.3915 8.53529 5.65816 7.96511 9.66439 12.013 14.1378 8.77457 11.3039 10.4848 numMergedOcc 0
6 mol 9 unq 0 iso 0 dist 7.9944 6.55811 4.58685 5.06358 7.032 8.64915 6.02809 6.32226 7.35972 4.98827 numMergedOcc 0
7 mol 9 unq 1 iso 0 dist 7.9944 7.36018 5.83039 5.06358 7.032 8.17347 6.02809 6.32226 9.93542 4.98827 numMergedOcc 0
8 mol 9 unq 2 iso 0 dist 7.9944 8.48677 9.06304 5.06358 7.032 11.3467 6.02809 6.32226 12.3519 4.98827 numMergedOcc 0
9 mol 9 unq 3 iso 0 dist 7.032 8.64915 4.58685 5.06358 7.9944 6.55811 4.98827 6.32226 7.35972 6.02809 numMergedOcc 0
10 mol 9 unq 4 iso 0 dist 7.032 8.17347 5.83039 5.06358 7.9944 7.36018 4.98827 6.32226 9.93542 6.02809 numMergedOcc 0
11 mol 9 unq 5 iso 0 dist 7.032 7.83133 9.193 5.06358 7.9944 10.2602 4.98827 6.32226 11.9655 6.02809 numMergedOcc 0
12 mol 19 unq 0 iso 0 dist 6.92532 7.75618 13.9675 10.8007 7.48847 15.4288 4.97119 6.39966 9.95212 6.42867 numMergedOcc 0
13 mol 19 unq 1 iso 0 dist 6.92532 7.75618 13.9675 5.03957 6.36455 12.3215 4.97119 6.39966 9.95212 6.01808 numMergedOcc 0
14 mol 24 unq 0 iso 0 dist 6.60423 9.41441 11.9395 7.05502 7.83786 16.0926 4.32034 9.69752 8.00171 9.6469 numMergedOcc 0
15 mol 24 unq 1 iso 0 dist 6.60423 9.41441 11.9395 7.05502 7.83786 16.0926 8.52463 9.36461 6.72323 14.6654 numMergedOcc 0
16 mol 24 unq 2 iso 0 dist 4.93188 8.70827 9.75636 12.3067 9.24958 9.12854 5.11617 4.90592 12.8389 13.2229 numMergedOcc 0
17 mol 24 unq 3 iso 0 dist 4.93188 8.70827 9.75636 12.3067 9.24958 9.12854 10.8238 8.16324 11.6684 6.7828 numMergedOcc 0
18 mol 24 unq 4 iso 0 dist 4.93188 6.73939 10.0715 12.3067 9.24958 18.673 5.11617 4.90592 6.72323 13.2229 numMergedOcc 0
19 mol 24 unq 5 iso 0 dist 4.93188 6.73939 10.0715 12.3067 9.24958 18.673 10.8238 8.16324 15.7523 6.7828 numMergedOcc 0
20 mol 24 unq 6 iso 0 dist 9.24958 9.12854 9.75636 12.3067 4.93188 8.70827 13.2229 4.90592 12.8389 5.11617 numMergedOcc 0
21 mol 24 unq 7 iso 0 dist 9.24958 9.12854 9.75636 12.3067 4.93188 8.70827 6.7828 8.16324 11.6684 10.8238 numMergedOcc 0
22 mol 60 unq 0 iso 0 dist 7.55695 9.90939 4.82351 7.29309 9.96399 10.5084 5.94827 4.65127 8.97364 11.2415 numMergedOcc 0
23 mol 60 unq 1 iso 0 dist 7.55695 9.90939 4.82351 5.00018 8.82176 11.6165 5.94827 4.65127 8.97364 5.32257 numMergedOcc 0
24 mol 98 unq 0 iso 0 dist 5.88354 5.59328 8.53212 4.50554 7.89665 10.0186 4.67519 6.62972 7.14031 6.6076 numMergedOcc 0
25 mol 98 unq 1 iso 0 dist 5.88354 5.59328 8.53212 7.40461 5.39354 10.3766 4.67519 6.62972 7.14031 10.6513 numMergedOcc 0
26 mol 98 unq 2 iso 0 dist 5.88354 5.59328 8.53212 7.72877 5.74854 7.5242 4.67519 6.62972 7.14031 10.4027 numMergedOcc 0
27 mol 98 unq 3 iso 0 dist 5.88354 5.59328 8.53212 10.51 8.76566 15.4911 4.67519 6.62972 7.14031 12.3568 numMergedOcc 0
28 mol 98 unq 4 iso 0 dist 5.88354 5.59328 8.53212 13.5683 8.8368 17.0991 4.67519 6.62972 7.14031 14.5457 numMergedOcc 0
29 mol 98 unq 5 iso 0 dist 5.74854 7.5242 8.53212 7.72877 5.88354 5.59328 10.4027 6.62972 7.14031 4.67519 numMergedOcc 0
30 mol 98 unq 6 iso 0 dist 5.74854 7.5242 8.53212 11.0242 7.89665 10.0186 10.4027 6.62972 7.14031 6.6076 numMergedOcc 0
31 mol 98 unq 7 iso 0 dist 5.74854 7.5242 8.53212 5.09649 5.39354 10.3766 10.4027 6.62972 7.14031 10.6513 numMergedOcc 0
32 mol 98 unq 8 iso 0 dist 5.74854 7.5242 8.53212 11.9511 8.76566 15.4911 10.4027 6.62972 7.14031 12.3568 numMergedOcc 0
33 mol 98 unq 9 iso 0 dist 5.74854 7.5242 8.53212 11.569 8.8368 17.0991 10.4027 6.62972 7.14031 14.5457 numMergedOcc 0
34 mol 131 unq 0 iso 0 dist 9.29384 8.70296 10.8127 13.2572 9.15431 15.7676 13.1439 5.44303 15.6807 6.51918 numMergedOcc 0
35 mol 131 unq 1 iso 0 dist 9.29384 8.70296 10.8127 13.2572 9.15431 15.7676 13.7237 8.50562 18.6956 9.60968 numMergedOcc 0
36 mol 131 unq 2 iso 0 dist 9.29384 8.70296 10.8127 6.63273 6.92648 12.6227 13.1439 5.44303 15.6807 7.92788 numMergedOcc 0
37 mol 131 unq 3 iso 0 dist 9.29384 8.70296 10.8127 6.63273 6.92648 12.6227 13.7237 8.50562 18.6956 8.23791 numMergedOcc 0
38 mol 131 unq 4 iso 0 dist 9.29384 9.25558 11.2516 13.2572 9.15431 18.3571 13.1439 5.44303 14.8175 6.51918 numMergedOcc 0
39 mol 131 unq 5 iso 0 dist 9.29384 9.25558 11.2516 13.2572 9.15431 18.3571 13.7237 8.50562 13.2952 9.60968 numMergedOcc 0
40 mol 131 unq 6 iso 0 dist 9.29384 9.25558 11.2516 6.63273 6.92648 11.586 13.1439 5.44303 14.8175 7.92788 numMergedOcc 0
41 mol 131 unq 7 iso 0 dist 9.29384 9.25558 11.2516 6.63273 6.92648 11.586 13.7237 8.50562 13.2952 8.23791 numMergedOcc 0
42 mol 141 unq 0 iso 0 dist 7.86572 9.97343 5.38571 6.21253 6.69515 11.0743 10.1432 4.46777 6.83404 10.1386 numMergedOcc 0
43 mol 141 unq 1 iso 0 dist 7.86572 9.97343 5.38571 6.21253 6.69515 11.0743 9.43674 6.94988 11.8798 7.42649 numMergedOcc 0
44 mol 181 unq 0 iso 0 dist 6.51749 8.90963 13.0913 10.1912 7.20392 18.0578 5.6044 7.11785 10.515 12.9468 numMergedOcc 0
45 mol 194 unq 0 iso 0 dist 6.26839 8.65535 5.92931 8.0179 8.12346 12.0009 11.6598 5.68348 6.1886 12.0887 numMergedOcc 0
46 mol 194 unq 1 iso 0 dist 6.26839 8.65535 5.92931 14.6506 8.83356 12.645 11.6598 5.68348 6.1886 7.11753 numMergedOcc 0
47 mol 194 unq 2 iso 0 dist 6.26839 8.65535 5.92931 8.48054 8.2654 13.9101 11.6598 5.68348 6.1886 12.8755 numMergedOcc 0
48 mol 194 unq 3 iso 0 dist 8.83356 8.29382 12.361 14.6506 6.26839 16.3687 7.11753 5.68348 12.3845 11.6598 numMergedOcc 0
49 mol 194 unq 4 iso 0 dist 8.83356 8.29382 12.361 13.5632 8.12346 18.4977 7.11753 5.68348 12.3845 12.0887 numMergedOcc 0
50 mol 194 unq 5 iso 0 dist 8.83356 8.29382 12.361 11.6097 8.2654 14.3769 7.11753 5.68348 12.3845 12.8755 numMergedOcc 0
51 mol 194 unq 6 iso 0 dist 8.83356 6.72379 7.50057 14.6506 6.26839 12.4952 7.11753 5.68348 6.38324 11.6598 numMergedOcc 0
52 mol 194 unq 7 iso 0 dist 8.83356 6.72379 7.50057 13.5632 8.12346 15.1649 7.11753 5.68348 6.38324 12.0887 numMergedOcc 0
53 mol 194 unq 8 iso 0 dist 8.83356 6.72379 7.50057 11.6097 8.2654 13.2138 7.11753 5.68348 6.38324 12.8755 numMergedOcc 0
54 mol 205 unq 0 iso 0 dist 5.60393 5.44002 8.46033 7.38516 8.44861 12.3113 14.4523 9.17946 17.31 13.0658 numMergedOcc 0
55 mol 258 unq 0 iso 0 dist 6.70815 7.21311 8.10604 7.26417 7.99477 11.2102 10.8558 9.91199 16.0544 13.2927 numMergedOcc 0
56 mol 279 unq 0 iso 0 dist 6.43341 9.09855 5.89415 6.67478 8.29305 13.6219 5.58929 9.30921 11.0829 9.37316 numMergedOcc 0
