0 mol 7 unq 0 iso 0 dist 7.38748 7.15287 6.8464 6.22892 5.0893 8.41585 12.1855 14.0737 12.8323 9.87885 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 5.85737 6.88453 8.0319 13.0211 11.4109 6.86014 11.3716 12.1911 5.69214 7.95042 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.84944 14.9082 8.03754 22.5146 14.0204 8.80331 19.936 12.8366 5.41726 6.6263 numMergedOcc 0
3 mol 43 unq 1 iso 0 dist 8.84944 14.9082 8.03754 19.6842 13.1056 6.20293 19.936 12.8366 5.41726 6.75943 numMergedOcc 0
4 mol 43 unq 2 iso 0 dist 7.21995 4.80528 8.03754 12.8866 14.0204 8.80331 8.39715 12.8366 5.41726 6.6263 numMergedOcc 0
5 mol 43 unq 3 iso 0 dist 7.21995 4.80528 8.03754 10.6604 13.1056 6.20293 8.39715 12.8366 5.41726 6.75943 numMergedOcc 0
6 mol 43 unq 4 iso 0 dist 7.32913 6.9067 9.47348 13.3384 9.92508 8.93915 16.4674 15.6164 10.0383 6.75943 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 8.15664 6.09495 7.11695 10.869 14.4144 9.33898 7.25403 11.295 4.3481 7.06939 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 8.15664 6.09495 7.11695 14.4679 9.54167 9.64443 11.176 10.9777 5.31547 9.36001 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 9.33293 9.48465 7.9258 16.9836 10.9791 9.33865 15.931 12.5457 6.63111 6.39384 numMergedOcc 0
10 mol 115 unq 1 iso 0 dist 9.33293 9.48465 7.9258 9.71126 4.75197 5.83991 5.84634 7.84768 4.48636 7.69765 numMergedOcc 0
11 mol 115 unq 2 iso 0 dist 9.33293 9.48465 7.9258 9.71126 4.75197 5.83991 15.931 12.5457 6.63111 9.42082 numMergedOcc 0
12 mol 133 unq 0 iso 0 dist 8.8353 17.2988 9.47554 15.7117 9.67676 8.00618 13.5483 10.3522 15.0115 8.77023 numMergedOcc 0
13 mol 152 unq 0 iso 0 dist 9.65031 14.069 8.41774 21.5408 13.1435 8.56324 19.1378 12.9285 5.39112 6.59889 numMergedOcc 0
14 mol 152 unq 1 iso 0 dist 9.65031 14.069 8.41774 21.5408 13.1435 8.56324 16.8145 11.2309 4.84714 8.9192 numMergedOcc 0
15 mol 152 unq 2 iso 0 dist 9.65031 14.069 8.41774 19.3797 13.793 6.70283 19.1378 12.9285 5.39112 6.70693 numMergedOcc 0
16 mol 152 unq 3 iso 0 dist 8.51844 4.46956 8.41774 12.7437 13.1435 8.56324 8.33963 12.9285 5.39112 6.59889 numMergedOcc 0
17 mol 152 unq 4 iso 0 dist 8.51844 4.46956 8.41774 12.7437 13.1435 8.56324 5.98466 11.2309 4.84714 8.9192 numMergedOcc 0
18 mol 152 unq 5 iso 0 dist 8.51844 4.46956 8.41774 10.5594 13.793 6.70283 8.33963 12.9285 5.39112 6.70693 numMergedOcc 0
19 mol 170 unq 0 iso 0 dist 8.10386 12.9081 9.32245 13.5425 6.45787 9.76807 11.6479 9.66676 4.78249 9.51256 numMergedOcc 0
20 mol 224 unq 0 iso 0 dist 8.8113 16.607 8.80858 10.2166 4.46743 6.65832 16.5165 10.0366 5.76843 6.99769 numMergedOcc 0
21 mol 224 unq 1 iso 0 dist 8.8113 16.607 8.80858 13.6975 4.93626 6.60589 16.5165 10.0366 5.76843 8.79428 numMergedOcc 0
22 mol 224 unq 2 iso 0 dist 8.8113 16.607 8.80858 19.4037 11.8641 9.16166 16.5165 10.0366 5.76843 6.8692 numMergedOcc 0
23 mol 236 unq 0 iso 0 dist 8.63249 10.2557 5.90804 6.36941 7.45579 6.27581 5.3331 10.2767 10.5774 9.3206 numMergedOcc 0
24 mol 236 unq 1 iso 0 dist 7.74348 6.49831 5.90804 12.2331 7.45579 6.27581 15.2955 10.2767 10.5774 9.3206 numMergedOcc 0
