0 mol 14 unq 0 iso 0 dist 8.73962 8.64855 9.18111 15.5387 18.6051 9.58196 14.0636 12.0749 5.53425 9.7022 numMergedOcc 0
1 mol 14 unq 1 iso 0 dist 8.73962 8.64855 9.18111 15.5387 18.6051 9.58196 11.8313 12.3698 4.53725 9.04767 numMergedOcc 0
2 mol 95 unq 0 iso 0 dist 6.82522 8.07365 5.33325 14.1188 9.65047 7.27724 12.3834 5.69671 8.41707 8.03644 numMergedOcc 0
3 mol 95 unq 1 iso 0 dist 9.89353 6.86713 5.69671 9.70895 9.65047 8.03644 12.4296 5.33325 8.41707 7.27724 numMergedOcc 0
4 mol 95 unq 2 iso 0 dist 9.35364 7.90775 15.7022 4.16047 12.7234 9.03572 9.96562 18.3936 6.59319 8.83255 numMergedOcc 0
5 mol 95 unq 3 iso 0 dist 9.35364 7.90775 15.7022 4.16047 12.7234 9.03572 11.3191 16.7208 16.6055 8.03644 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 5.93206 9.23803 4.93112 6.32175 8.73648 8.58044 11.1563 9.47324 7 7.34473 numMergedOcc 0
7 mol 109 unq 1 iso 0 dist 5.93206 9.23803 4.93112 6.32175 8.73648 8.58044 8.05028 4.48038 6.94915 9.97763 numMergedOcc 0
8 mol 109 unq 2 iso 0 dist 5.93206 8.05028 4.48038 6.32175 8.73648 9.97763 11.1563 9.47324 8.40993 7.34473 numMergedOcc 0
9 mol 109 unq 3 iso 0 dist 5.93206 8.05028 4.48038 6.32175 8.73648 9.97763 9.23803 4.93112 6.94915 8.58044 numMergedOcc 0
10 mol 109 unq 4 iso 0 dist 7.73529 9.23803 10.5733 6.32175 12.2141 8.58044 11.1563 12.7688 7 7.34473 numMergedOcc 0
11 mol 109 unq 5 iso 0 dist 7.73529 9.23803 10.5733 6.32175 12.2141 8.58044 8.05028 4.76017 6.94915 9.97763 numMergedOcc 0
12 mol 109 unq 6 iso 0 dist 7.73529 8.05028 4.76017 6.32175 12.2141 9.97763 11.1563 12.7688 8.40993 7.34473 numMergedOcc 0
13 mol 109 unq 7 iso 0 dist 7.73529 8.05028 4.76017 6.32175 12.2141 9.97763 9.23803 10.5733 6.94915 8.58044 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 6.26722 8.66715 12.7925 14.0905 18.2779 7.11802 9.00172 12.7637 8.18495 8.00618 numMergedOcc 0
15 mol 133 unq 1 iso 0 dist 6.26722 9.00172 12.7637 14.0905 18.2779 8.00618 8.66715 12.7925 8.18495 7.11802 numMergedOcc 0
16 mol 133 unq 2 iso 0 dist 5.63173 8.95433 5.36939 11.0811 10.8427 7.11802 13.7786 12.4925 8.18495 8.00618 numMergedOcc 0
17 mol 134 unq 0 iso 0 dist 8.49649 5.79157 6.36794 13.0109 9.55556 9.86662 9.87619 11.9294 6.81259 8.94367 numMergedOcc 0
18 mol 134 unq 1 iso 0 dist 8.49649 5.79157 6.36794 14.1608 12.1043 9.71307 9.87619 11.9294 6.81259 6.37586 numMergedOcc 0
19 mol 205 unq 0 iso 0 dist 8.95136 9.25882 10.6076 9.40714 8.87534 7.80463 13.7769 10.0861 8.18714 6.03031 numMergedOcc 0
20 mol 205 unq 1 iso 0 dist 8.95136 9.25882 10.6076 9.40714 8.87534 7.80463 16.4532 13.5482 13.8543 7.26832 numMergedOcc 0
21 mol 229 unq 0 iso 0 dist 4.38586 8.53615 8.65216 6.81165 8.6537 8.22528 11.0334 10.7439 5.57838 7.03423 numMergedOcc 0
22 mol 236 unq 0 iso 0 dist 6.79115 5.77925 4.38595 6.59536 11.3361 8.03456 11.8216 11.247 7.28249 9.81562 numMergedOcc 0
23 mol 236 unq 1 iso 0 dist 6.79115 5.77925 4.38595 8.93012 9.89665 6.84306 11.8216 11.247 7.28249 7.68742 numMergedOcc 0
24 mol 236 unq 2 iso 0 dist 6.79115 5.77925 4.38595 12.1686 14.0991 9.99038 11.8216 11.247 7.28249 6.27581 numMergedOcc 0
25 mol 236 unq 3 iso 0 dist 6.79115 5.77925 4.38595 10.5925 9.05929 8.35971 10.4879 4.32403 7.43758 8.04248 numMergedOcc 0
26 mol 253 unq 0 iso 0 dist 4.92572 7.38315 9.71999 10.6994 14.983 7.32223 13.8059 16.0169 7.25988 8.31064 numMergedOcc 0
27 mol 258 unq 0 iso 0 dist 9.45685 9.2067 11.716 9.88911 15.0351 6.42289 11.1938 11.5659 7.26417 6.60405 numMergedOcc 0
