0 mol 19 unq 0 iso 0 dist 8.40416 6.74265 7.02548 10.7864 5.46754 5.64498 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 7.75618 5.5841 7.02548 6.50337 5.46754 5.64498 numMergedOcc 0
2 mol 27 unq 0 iso 0 dist 9.52474 7.50515 7.60283 8.8018 13.3658 7.56229 numMergedOcc 0
3 mol 27 unq 1 iso 0 dist 9.52474 7.50515 7.60283 13.3976 5.92112 9.94082 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 7.56205 11.7069 6.04903 17.2252 10.029 9.27478 numMergedOcc 0
5 mol 62 unq 1 iso 0 dist 7.56205 11.7069 6.04903 13.0601 9.53337 6.38768 numMergedOcc 0
6 mol 62 unq 2 iso 0 dist 7.56205 11.7069 6.04903 9.854 6.71999 6.31321 numMergedOcc 0
7 mol 62 unq 3 iso 0 dist 4.74544 5.49555 6.04903 10.0117 10.029 9.27478 numMergedOcc 0
8 mol 62 unq 4 iso 0 dist 4.74544 5.49555 6.04903 10.775 9.53337 6.38768 numMergedOcc 0
9 mol 62 unq 5 iso 0 dist 4.74544 5.49555 6.04903 9.1216 6.71999 6.31321 numMergedOcc 0
10 mol 85 unq 0 iso 0 dist 9.82915 15.8792 6.05495 11.6471 6.64001 9.03785 numMergedOcc 0
11 mol 85 unq 1 iso 0 dist 9.82915 15.8792 6.05495 8.77199 4.58085 8.97148 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 9.22232 12.0863 8.21165 17.0988 15.0869 7.26577 numMergedOcc 0
13 mol 148 unq 0 iso 0 dist 9.91993 10.2478 8.73468 13.501 6.05109 8.60089 numMergedOcc 0
14 mol 148 unq 1 iso 0 dist 9.99156 6.84291 8.73468 13.2345 6.05109 8.60089 numMergedOcc 0
15 mol 148 unq 2 iso 0 dist 6.22055 10.2478 9.73927 13.501 9.44448 8.60089 numMergedOcc 0
16 mol 148 unq 3 iso 0 dist 8.18085 6.84291 9.73927 13.2345 9.44448 8.60089 numMergedOcc 0
17 mol 150 unq 0 iso 0 dist 9.96691 10.2318 8.73558 13.5531 6.21463 8.54995 numMergedOcc 0
18 mol 150 unq 1 iso 0 dist 9.8656 6.79619 8.73558 13.1531 6.21463 8.54995 numMergedOcc 0
19 mol 150 unq 2 iso 0 dist 6.14675 10.2318 9.66129 13.5531 9.57325 8.54995 numMergedOcc 0
20 mol 150 unq 3 iso 0 dist 7.94889 6.79619 9.66129 13.1531 9.57325 8.54995 numMergedOcc 0
21 mol 159 unq 0 iso 0 dist 8.4858 4.57561 5.9032 12.6419 5.36609 8.84829 numMergedOcc 0
22 mol 174 unq 0 iso 0 dist 9.87122 8.37744 7.47932 11.5501 6.19344 6.29723 numMergedOcc 0
23 mol 227 unq 0 iso 0 dist 5.41321 6.43754 7.57454 10.1659 7.3021 6.38497 numMergedOcc 0
24 mol 264 unq 0 iso 0 dist 5.93616 5.12409 5.91213 8.48407 10.7977 7.26094 numMergedOcc 0
