0 mol 24 unq 0 iso 0 dist 9.54519 13.2653 5.54419 8.70141 4.33963 4.93188 12.8473 11.2485 9.48345 9.40479 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.54519 13.2653 5.54419 8.70141 4.33963 4.93188 4.36056 11.9933 14.4162 9.58012 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 9.54519 5.80023 7.36323 8.70141 4.33963 9.24958 12.8473 11.2485 13.1456 9.40479 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 9.54519 5.80023 7.36323 8.70141 4.33963 9.24958 4.36056 11.9933 10.0655 9.58012 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 6.11056 10.4744 8.86116 10.9853 5.97304 6.60423 5.36722 6.72502 6.58998 9.38831 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 8.38387 11.0096 8.80331 16.6874 9.06158 9.93832 15.4696 10.0649 7.05402 7.31982 numMergedOcc 0
6 mol 43 unq 1 iso 0 dist 8.38387 11.8286 6.20293 16.6874 9.06158 8.60739 15.4696 10.0649 5.48048 7.31982 numMergedOcc 0
7 mol 112 unq 0 iso 0 dist 7.15985 6.68714 9.60462 7.98999 3.98564 7.23962 13.0525 13.2485 6.89221 9.74569 numMergedOcc 0
8 mol 112 unq 1 iso 0 dist 7.15985 6.71889 7.45389 7.98999 3.98564 7.30204 13.0525 13.2485 9.96887 9.74569 numMergedOcc 0
9 mol 115 unq 0 iso 0 dist 9.35868 8.25001 7.30858 11.9843 5.61704 5.72642 8.59786 10.0289 7.21418 8.71286 numMergedOcc 0
10 mol 115 unq 1 iso 0 dist 5.02717 11.0268 7.88312 11.1443 7.21418 5.74857 4.92962 5.72642 7.3094 8.71286 numMergedOcc 0
11 mol 115 unq 2 iso 0 dist 4.98864 10.9437 7.88312 11.2871 7.3094 5.72642 5.01124 5.74857 7.21418 8.71286 numMergedOcc 0
12 mol 115 unq 3 iso 0 dist 7.95871 12.0354 7.88312 14.361 7.3094 5.72642 7.39793 5.74857 7.21418 8.71286 numMergedOcc 0
13 mol 119 unq 0 iso 0 dist 5.63005 10.5268 8.73993 9.15988 3.78311 7.77116 9.79485 8.56342 4.91132 8.03035 numMergedOcc 0
14 mol 119 unq 1 iso 0 dist 5.63005 10.5268 8.73993 9.15988 3.78311 7.77116 6.81112 6.37542 6.08167 7.6968 numMergedOcc 0
15 mol 131 unq 0 iso 0 dist 6.31125 4.29914 7.12972 10.5132 9.32969 6.92648 15.8449 16.4092 11.5688 7.76594 numMergedOcc 0
16 mol 131 unq 1 iso 0 dist 6.31125 5.59449 6.85062 10.5132 9.32969 9.29384 15.8449 16.4092 15.7796 7.76594 numMergedOcc 0
17 mol 152 unq 0 iso 0 dist 8.07256 10.4039 8.56324 16.5342 9.35627 9.77552 15.2644 10.4911 7.2238 6.39031 numMergedOcc 0
18 mol 152 unq 1 iso 0 dist 8.07256 11.1874 6.70283 16.5342 9.35627 8.28642 15.2644 10.4911 5.59336 6.39031 numMergedOcc 0
19 mol 227 unq 0 iso 0 dist 9.07872 9.9474 7.09863 18.2547 12.9587 8.38865 16.8257 12.2278 10.5813 9.56257 numMergedOcc 0
20 mol 238 unq 0 iso 0 dist 9.94315 12.521 5.72887 16.6013 12.3808 7.32982 12.1653 11.2809 10.7551 9.89583 numMergedOcc 0
21 mol 238 unq 1 iso 0 dist 8.59074 9.18011 5.72887 13.3717 12.3808 7.32982 12.2456 11.2809 10.7551 9.89583 numMergedOcc 0
22 mol 238 unq 2 iso 0 dist 6.2365 4.7157 5.72887 10.8216 12.3808 7.32982 13.3679 11.2809 10.7551 9.89583 numMergedOcc 0
23 mol 258 unq 0 iso 0 dist 5.73834 6.48867 6.60405 11.329 7.42673 6.70815 10.6333 9.53063 6.6525 6.47194 numMergedOcc 0
24 mol 258 unq 1 iso 0 dist 5.73834 7.52881 6.42289 11.329 7.42673 7.99477 10.6333 9.53063 5.27959 6.47194 numMergedOcc 0
