0 mol 16 unq 0 iso 0 dist 5.05803 7.03948 6.2983 6.42835 5.01101 9.87867 6.92781 6.31718 5.47769 11.0298 6.57331 4.65873 4.68733 6.09368 8.43054 numMergedOcc 0
1 mol 16 unq 1 iso 0 dist 6.31718 5.47769 6.2983 8.43054 4.65873 4.68733 6.92781 5.05803 7.03948 6.57331 11.0298 5.01101 9.87867 6.09368 6.42835 numMergedOcc 0
2 mol 58 unq 0 iso 0 dist 6.62496 9.64665 4.67832 9.22598 9.87158 8.59939 4.81926 6.35756 9.66798 8.96727 9.55996 5.86526 4.03439 6.20884 8.01308 numMergedOcc 0
3 mol 58 unq 1 iso 0 dist 6.35756 8.89374 6.47744 8.01308 5.86526 9.47022 4.81926 6.62496 11.5023 9.55996 8.96727 9.87158 14.6599 6.20884 9.22598 numMergedOcc 0
4 mol 72 unq 0 iso 0 dist 9.96708 6.77912 7.11552 7.12321 7.47371 9.88768 8.24309 9.78528 11.9814 6.21799 9.35457 9.67587 12.9007 3.43675 5.03251 numMergedOcc 0
5 mol 72 unq 1 iso 0 dist 9.96708 6.77912 7.11552 7.12321 7.47371 9.88768 8.24309 9.78528 11.9814 6.21799 12.1131 7.07356 12.9235 5.75711 7.66093 numMergedOcc 0
6 mol 72 unq 2 iso 0 dist 9.78528 9.02278 11.6894 5.03251 9.67587 4.01021 8.24309 9.96708 12.0903 9.35457 6.21799 7.47371 5.5067 3.43675 7.12321 numMergedOcc 0
7 mol 72 unq 3 iso 0 dist 9.78528 9.02278 11.6894 7.66093 7.07356 6.40102 8.24309 9.96708 12.0903 12.1131 6.21799 7.47371 5.5067 5.75711 7.12321 numMergedOcc 0
8 mol 73 unq 0 iso 0 dist 9.96396 8.70133 7.41074 9.73086 5.70116 6.15714 5.4148 6.19304 4.65521 7.4369 12.2276 6.20232 6.10063 3.30399 8.68662 numMergedOcc 0
9 mol 73 unq 1 iso 0 dist 9.96396 8.70133 7.41074 9.73086 5.70116 6.15714 14.9342 8.70481 15.9587 12.8207 13.3207 11.2069 17.2861 14.2015 5.5087 numMergedOcc 0
10 mol 73 unq 2 iso 0 dist 9.96396 8.70133 7.41074 9.73086 5.70116 6.15714 14.9342 8.70481 15.9587 12.8207 14.498 10.6713 16.8311 12.1341 6.08682 numMergedOcc 0
11 mol 73 unq 3 iso 0 dist 6.19304 4.65521 7.41074 8.68662 6.20232 6.10063 5.4148 9.96396 8.70133 12.2276 7.4369 5.70116 6.15714 3.30399 9.73086 numMergedOcc 0
12 mol 73 unq 4 iso 0 dist 6.19304 4.65521 7.41074 8.68662 6.20232 6.10063 13.3558 8.70481 15.9587 13.8931 13.8368 11.2069 17.2861 16.3057 5.5087 numMergedOcc 0
13 mol 73 unq 5 iso 0 dist 6.19304 4.65521 7.41074 8.68662 6.20232 6.10063 13.3558 8.70481 15.9587 13.8931 14.5999 10.6713 16.8311 14.162 6.08682 numMergedOcc 0
14 mol 73 unq 6 iso 0 dist 6.19304 4.65521 7.41074 7.4369 5.70116 6.15714 13.3558 8.70481 15.9587 12.8207 13.8368 11.2069 17.2861 14.2015 5.5087 numMergedOcc 0
15 mol 73 unq 7 iso 0 dist 6.19304 4.65521 7.41074 7.4369 5.70116 6.15714 13.3558 8.70481 15.9587 12.8207 14.5999 10.6713 16.8311 12.1341 6.08682 numMergedOcc 0
16 mol 100 unq 0 iso 0 dist 7.47343 8.72704 10.1589 7.82475 5.9143 12.5061 8.8807 6.65086 10.5193 11.9928 9.76432 6.23008 6.13211 9.68983 8.91882 numMergedOcc 0
17 mol 100 unq 1 iso 0 dist 7.47343 8.72704 10.1589 5.35782 5.47563 12.1093 8.8807 6.65086 10.5193 9.94341 9.76432 6.23008 6.13211 10.2797 8.91882 numMergedOcc 0
18 mol 115 unq 0 iso 0 dist 9.33865 9.66954 6.09023 6.39384 6.63111 6.49835 7.69052 5.83991 8.66155 9.42082 13.4105 4.48636 9.13361 11.044 7.69765 numMergedOcc 0
19 mol 115 unq 1 iso 0 dist 9.33865 7.64585 10.2377 6.39384 6.63111 5.65471 7.69052 5.83991 12.2309 9.42082 13.4105 4.48636 14.211 11.044 7.69765 numMergedOcc 0
20 mol 115 unq 2 iso 0 dist 5.83991 8.66155 6.09023 7.69765 4.48636 9.13361 7.69052 9.33865 9.66954 13.4105 9.42082 6.63111 6.49835 11.044 6.39384 numMergedOcc 0
21 mol 115 unq 3 iso 0 dist 5.83991 7.76729 10.9739 6.24825 6.01673 5.78043 10.8507 7.30858 17.6696 13.22 10.5599 5.03039 15.1254 9.74247 6.04595 numMergedOcc 0
22 mol 115 unq 4 iso 0 dist 6.11741 9.66954 4.61908 6.39384 6.07067 6.49835 7.69052 7.88312 8.66155 9.42082 13.4105 11.835 9.13361 11.044 7.69765 numMergedOcc 0
23 mol 115 unq 5 iso 0 dist 6.11741 7.64585 10.8939 6.39384 6.07067 5.65471 7.69052 7.88312 12.2309 9.42082 13.4105 11.835 14.211 11.044 7.69765 numMergedOcc 0
24 mol 115 unq 6 iso 0 dist 7.88312 8.66155 4.61908 7.69765 11.835 9.13361 7.69052 6.11741 9.66954 13.4105 9.42082 6.07067 6.49835 11.044 6.39384 numMergedOcc 0
25 mol 117 unq 0 iso 0 dist 7.90328 6.62561 4.91401 6.10127 10.5783 6.95589 7.22206 7.83136 7.63616 11.6387 10.4223 3.55765 5.56883 12.4037 8.19331 numMergedOcc 0
26 mol 117 unq 1 iso 0 dist 7.90328 6.62561 4.91401 6.10127 10.5783 6.95589 9.3584 7.0603 10.6107 14.762 10.4223 3.55765 5.56883 12.4037 8.85711 numMergedOcc 0
27 mol 117 unq 2 iso 0 dist 7.83136 7.63616 4.91401 8.19331 3.55765 5.56883 7.22206 7.90328 6.62561 10.4223 11.6387 10.5783 6.95589 12.4037 6.10127 numMergedOcc 0
28 mol 134 unq 0 iso 0 dist 8.94367 8.79571 5.41704 7.21868 8.06642 5.67107 5.49782 6.37586 5.42582 7.93372 13.9752 6.95573 6.0991 11.4107 9.33924 numMergedOcc 0
29 mol 134 unq 1 iso 0 dist 6.37586 5.42582 5.41704 9.33924 6.95573 6.0991 5.49782 8.94367 8.79571 13.9752 7.93372 8.06642 5.67107 11.4107 7.21868 numMergedOcc 0
30 mol 134 unq 2 iso 0 dist 9.86662 8.79571 6.17103 7.21868 4.00092 5.67107 5.49782 9.71307 5.42582 7.93372 13.9752 10.2026 6.0991 11.4107 9.33924 numMergedOcc 0
31 mol 134 unq 3 iso 0 dist 9.71307 5.42582 6.17103 9.33924 10.2026 6.0991 5.49782 9.86662 8.79571 13.9752 7.93372 4.00092 5.67107 11.4107 7.21868 numMergedOcc 0
32 mol 142 unq 0 iso 0 dist 9.2313 7.15475 9.49653 7.18002 13.5913 12.2806 5.32922 5.31024 9.07935 10.7696 7.81207 4.67662 5.26247 13.4681 6.14151 numMergedOcc 0
33 mol 142 unq 1 iso 0 dist 5.31024 9.07935 9.49653 6.14151 4.67662 5.26247 5.32922 9.2313 7.15475 7.81207 10.7696 13.5913 12.2806 13.4681 7.18002 numMergedOcc 0
34 mol 142 unq 2 iso 0 dist 7.73169 7.15475 7.53854 7.18002 9.99555 12.2806 5.32922 7.26382 9.07935 10.7696 7.81207 5.81599 5.26247 13.4681 6.14151 numMergedOcc 0
35 mol 142 unq 3 iso 0 dist 7.26382 9.07935 7.53854 6.14151 5.81599 5.26247 5.32922 7.73169 7.15475 7.81207 10.7696 9.99555 12.2806 13.4681 7.18002 numMergedOcc 0
36 mol 192 unq 0 iso 0 dist 5.59424 8.36822 5.71262 9.78634 9.53265 10.3099 5.76246 7.00794 12.1647 12.8149 5.64942 6.35474 10.1087 5.9655 6.97962 numMergedOcc 0
37 mol 192 unq 1 iso 0 dist 5.59424 8.36822 5.71262 9.78634 9.53265 10.3099 5.76246 7.00794 12.1647 12.8149 7.43054 5.25965 10.0566 7.70298 6.79229 numMergedOcc 0
38 mol 192 unq 2 iso 0 dist 5.59424 8.36822 5.71262 5.64942 6.35474 10.1087 5.76246 7.00794 12.1647 6.97962 7.43054 5.25965 10.0566 3.60331 6.79229 numMergedOcc 0
39 mol 192 unq 3 iso 0 dist 5.59424 8.36822 5.71262 7.43054 5.25965 10.0566 5.76246 7.00794 12.1647 6.79229 5.64942 6.35474 10.1087 3.60331 6.97962 numMergedOcc 0
40 mol 259 unq 0 iso 0 dist 7.88519 7.48005 11.6195 9.63573 7.20604 9.98303 4.69778 8.13497 10.9591 12.8229 7.66153 8.8603 14.0829 10.3051 9.07743 numMergedOcc 0
