0 mol 1 unq 0 iso 0 dist 8.70365 9.56692 13.0376 7.42008 15.1718 9.44115 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.70365 9.56692 13.0376 5.96722 11.0933 7.90928 numMergedOcc 0
2 mol 1 unq 2 iso 0 dist 9.33719 9.56692 5.972 7.42008 8.61411 9.44115 numMergedOcc 0
3 mol 1 unq 3 iso 0 dist 9.33719 9.56692 5.972 5.96722 11.2596 7.90928 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 8.46207 6.96665 13.13 7.90807 15.5106 7.09641 numMergedOcc 0
5 mol 64 unq 0 iso 0 dist 9.51572 8.81795 10.6025 8.92627 13.4574 6.72151 numMergedOcc 0
6 mol 67 unq 0 iso 0 dist 4.52009 8.57393 5.52457 8.59074 6.23298 5.70192 numMergedOcc 0
7 mol 67 unq 1 iso 0 dist 4.52009 8.57393 5.52457 10.4436 9.85405 7.65646 numMergedOcc 0
8 mol 67 unq 2 iso 0 dist 8.28902 6.04885 5.52457 8.36652 6.23298 5.70192 numMergedOcc 0
9 mol 67 unq 3 iso 0 dist 8.28902 6.04885 5.52457 6.53985 9.85405 7.65646 numMergedOcc 0
10 mol 100 unq 0 iso 0 dist 8.07051 9.01727 7.59628 11.6306 8.52125 7.90328 numMergedOcc 0
11 mol 103 unq 0 iso 0 dist 6.13194 8.68825 4.95298 6.21393 6.71671 8.42487 numMergedOcc 0
12 mol 119 unq 0 iso 0 dist 9.39818 9.87854 8.00732 13.3215 16.0778 8.95838 numMergedOcc 0
13 mol 119 unq 1 iso 0 dist 9.39818 9.87854 8.00732 6.17994 5.28955 9.47892 numMergedOcc 0
14 mol 133 unq 0 iso 0 dist 6.90904 8.1716 6.8965 4.77272 9.31907 8.9344 numMergedOcc 0
15 mol 148 unq 0 iso 0 dist 7.76167 6.3102 6.94302 5.92269 6.60739 8.07915 numMergedOcc 0
16 mol 148 unq 1 iso 0 dist 8.63766 6.3102 12.3565 5.92269 9.22427 8.07915 numMergedOcc 0
17 mol 148 unq 2 iso 0 dist 8.42082 6.3102 5.58057 5.92269 5.55129 8.07915 numMergedOcc 0
18 mol 150 unq 0 iso 0 dist 7.83202 6.25629 6.83379 5.95123 6.71763 7.97801 numMergedOcc 0
19 mol 150 unq 1 iso 0 dist 8.7107 6.25629 12.2713 5.95123 9.32504 7.97801 numMergedOcc 0
20 mol 150 unq 2 iso 0 dist 8.47493 6.25629 5.55906 5.95123 5.53778 7.97801 numMergedOcc 0
21 mol 197 unq 0 iso 0 dist 6.66634 9.69154 5.92782 9.71601 6.50727 8.32685 numMergedOcc 0
22 mol 197 unq 1 iso 0 dist 6.66634 9.69154 5.92782 13.0921 7.84826 6.74777 numMergedOcc 0
23 mol 197 unq 2 iso 0 dist 6.66634 9.69154 5.92782 17.3782 12.314 9.62514 numMergedOcc 0
24 mol 239 unq 0 iso 0 dist 8.78029 7.48307 6.62271 6.41922 10.7828 5.648 numMergedOcc 0
25 mol 248 unq 0 iso 0 dist 8.50325 9.59898 10.4745 8.43114 15.2798 8.97536 numMergedOcc 0
26 mol 269 unq 0 iso 0 dist 6.78303 7.37926 4.52168 4.50547 7.97206 5.98602 numMergedOcc 0
27 mol 269 unq 1 iso 0 dist 6.78303 7.37926 4.52168 5.57581 7.1068 9.78238 numMergedOcc 0
28 mol 294 unq 0 iso 0 dist 8.80158 7.15628 9.29471 11.7507 12.1658 7.12793 numMergedOcc 0
29 mol 294 unq 1 iso 0 dist 8.80158 7.15628 9.29471 11.1933 14.9111 6.21208 numMergedOcc 0
