0 mol 24 unq 0 iso 0 dist 9.54519 13.2653 5.54419 12.1061 8.4051 5.11617 8.70141 4.33963 4.93188 4.90592 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.54519 13.2653 5.54419 6.53276 8.23446 13.1779 8.70141 4.33963 4.93188 9.32328 numMergedOcc 0
2 mol 24 unq 2 iso 0 dist 9.54519 13.2653 5.54419 6.81998 8.75662 10.8238 8.70141 4.33963 4.93188 8.16324 numMergedOcc 0
3 mol 24 unq 3 iso 0 dist 9.54519 5.80023 7.36323 12.1061 8.4051 13.2229 8.70141 4.33963 9.24958 4.90592 numMergedOcc 0
4 mol 24 unq 4 iso 0 dist 9.54519 5.80023 7.36323 6.53276 8.23446 6.38336 8.70141 4.33963 9.24958 9.32328 numMergedOcc 0
5 mol 24 unq 5 iso 0 dist 9.54519 5.80023 7.36323 6.81998 8.75662 6.7828 8.70141 4.33963 9.24958 8.16324 numMergedOcc 0
6 mol 24 unq 6 iso 0 dist 6.11056 10.4744 8.86116 11.095 8.60554 8.52463 10.9853 5.97304 6.60423 9.36461 numMergedOcc 0
7 mol 24 unq 7 iso 0 dist 6.11056 10.4744 8.86116 4.04757 8.44664 10.971 10.9853 5.97304 6.60423 11.9865 numMergedOcc 0
8 mol 24 unq 8 iso 0 dist 6.11056 10.4744 8.86116 6.66757 9.44691 13.4893 10.9853 5.97304 6.60423 14.4545 numMergedOcc 0
9 mol 25 unq 0 iso 0 dist 8.88413 5.59268 7.17969 10.7087 7.55264 6.08585 5.97432 10.1525 6.90155 12.7162 numMergedOcc 0
10 mol 25 unq 1 iso 0 dist 7.63928 6.17631 6.03987 9.78075 6.85556 5.68392 5.97432 8.4666 5.81959 11.3646 numMergedOcc 0
11 mol 43 unq 0 iso 0 dist 8.38387 11.0096 8.80331 7.13085 8.95682 6.18002 16.6874 9.06158 9.93832 14.2655 numMergedOcc 0
12 mol 43 unq 1 iso 0 dist 8.38387 11.8286 6.20293 7.13085 8.95682 8.38399 16.6874 9.06158 8.60739 14.2655 numMergedOcc 0
13 mol 85 unq 0 iso 0 dist 6.58793 10.1919 7.95579 3.88757 7.54568 10.2865 11.4371 5.08358 8.00777 12.1999 numMergedOcc 0
14 mol 85 unq 1 iso 0 dist 6.58793 9.21014 6.19965 3.88757 7.54568 8.09967 11.4371 5.08358 7.1589 12.1999 numMergedOcc 0
15 mol 119 unq 0 iso 0 dist 5.63005 10.5268 8.73993 4.01593 6.52773 7.20179 9.15988 3.78311 7.77116 8.8562 numMergedOcc 0
16 mol 119 unq 1 iso 0 dist 5.63005 10.5268 8.73993 13.1254 9.23858 9.89358 9.15988 3.78311 7.77116 7.91683 numMergedOcc 0
17 mol 129 unq 0 iso 0 dist 6.38163 10.0961 5.83384 7.03404 6.28565 4.55551 11.14 6.67948 8.03372 9.94578 numMergedOcc 0
18 mol 129 unq 1 iso 0 dist 6.38163 10.0961 5.83384 4.92611 7.58957 10.5488 11.14 6.67948 8.03372 13.9747 numMergedOcc 0
19 mol 131 unq 0 iso 0 dist 6.31125 5.6098 8.40312 11.127 9.90168 7.7567 10.1423 5.89022 8.86329 5.56627 numMergedOcc 0
20 mol 131 unq 1 iso 0 dist 6.31125 4.29914 7.12972 11.127 9.90168 8.23791 10.1423 5.89022 8.71039 5.56627 numMergedOcc 0
21 mol 131 unq 2 iso 0 dist 6.31125 4.29914 7.12972 11.127 9.90168 8.23791 10.5132 9.32969 6.92648 8.50562 numMergedOcc 0
22 mol 131 unq 3 iso 0 dist 6.31125 5.59449 6.85062 11.127 9.90168 13.7237 10.5132 9.32969 9.29384 8.50562 numMergedOcc 0
23 mol 205 unq 0 iso 0 dist 5.96555 4.6995 6.03031 3.99238 6.03688 8.15057 10.6084 5.28092 8.44861 11.2584 numMergedOcc 0
24 mol 205 unq 1 iso 0 dist 5.96555 10.7091 7.26832 3.99238 6.03688 12.4957 10.6084 5.28092 5.60393 11.2584 numMergedOcc 0
25 mol 227 unq 0 iso 0 dist 9.07872 9.9474 7.09863 4.21811 6.02296 6.35849 18.2547 12.9587 8.38865 14.3567 numMergedOcc 0
26 mol 232 unq 0 iso 0 dist 9.29752 9.60401 8.27212 6.36084 9.40808 4.9377 10.1474 8.25884 7.83711 6.57921 numMergedOcc 0
27 mol 274 unq 0 iso 0 dist 9.71801 5.9882 7.56915 4.36131 8.52587 5.29529 7.65671 5.90436 9.56685 8.2997 numMergedOcc 0
28 mol 274 unq 1 iso 0 dist 9.71801 5.9882 7.56915 4.36131 8.52587 5.29529 7.3996 9.27829 8.49922 10.4781 numMergedOcc 0
