0 mol 1 unq 0 iso 0 dist 8.47429 9.40282 6.25854 4.61559 7.21349 6.4181 numMergedOcc 0
1 mol 1 unq 1 iso 0 dist 8.47429 9.35554 14.6429 4.61559 7.21349 12.2079 numMergedOcc 0
2 mol 14 unq 0 iso 0 dist 8.31896 9.28341 4.05028 4.97366 8.25832 6.87018 numMergedOcc 0
3 mol 56 unq 0 iso 0 dist 7.68259 5.84326 4.61096 11.629 9.49487 11.4701 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 7.32868 9.96446 9.29076 5.27016 9.61119 8.4545 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 7.32868 6.70686 4.39652 5.27016 9.61119 7.01176 numMergedOcc 0
6 mol 95 unq 0 iso 0 dist 6.82522 8.07365 5.33325 5.73392 8.36326 12.146 numMergedOcc 0
7 mol 95 unq 1 iso 0 dist 9.89353 6.86713 5.69671 13.5149 8.36326 12.7234 numMergedOcc 0
8 mol 95 unq 2 iso 0 dist 9.35364 7.90775 15.7022 4.84407 8.36326 12.5791 numMergedOcc 0
9 mol 95 unq 3 iso 0 dist 9.35364 8.49531 3.96825 4.84407 8.36326 8.69069 numMergedOcc 0
10 mol 163 unq 0 iso 0 dist 9.04436 7.75045 4.12904 14.0285 7.5447 11.6021 numMergedOcc 0
11 mol 163 unq 1 iso 0 dist 9.04436 7.75045 4.12904 4.49316 9.04757 9.63873 numMergedOcc 0
12 mol 169 unq 0 iso 0 dist 9.19569 6.28961 4.34424 14.3008 9.83308 11.0485 numMergedOcc 0
13 mol 188 unq 0 iso 0 dist 8.72253 7.24099 4.04545 5.88388 9.5523 10.1087 numMergedOcc 0
14 mol 196 unq 0 iso 0 dist 6.28071 9.36732 9.8977 9.31621 7.556 15.8315 numMergedOcc 0
15 mol 196 unq 1 iso 0 dist 6.28071 9.79271 4.59462 9.31621 7.556 9.99314 numMergedOcc 0
16 mol 233 unq 0 iso 0 dist 4.91191 6.48196 6.52848 10.5268 7.74693 14.1896 numMergedOcc 0
17 mol 235 unq 0 iso 0 dist 6.91126 6.45574 6.84447 9.7911 8.92054 8.48065 numMergedOcc 0
18 mol 237 unq 0 iso 0 dist 5.73318 9.59483 4.51174 5.58879 7.66306 12.1517 numMergedOcc 0
19 mol 253 unq 0 iso 0 dist 4.92572 7.38315 9.71999 4.09539 5.86892 9.1566 numMergedOcc 0
20 mol 258 unq 0 iso 0 dist 9.45685 9.2067 11.716 8.35629 9.64278 13.5424 numMergedOcc 0
21 mol 258 unq 1 iso 0 dist 9.45685 9.2067 11.716 5.17102 6.15713 11.4077 numMergedOcc 0
22 mol 258 unq 2 iso 0 dist 9.45685 9.16078 12.9218 8.35629 9.64278 16.0776 numMergedOcc 0
23 mol 258 unq 3 iso 0 dist 9.45685 9.16078 12.9218 5.17102 6.15713 12.7091 numMergedOcc 0
24 mol 278 unq 0 iso 0 dist 8.79625 9.91518 13.5373 4.46246 7.79408 12.9874 numMergedOcc 0
25 mol 285 unq 0 iso 0 dist 9.33149 9.82717 4.16039 14.8277 8.12306 12.0919 numMergedOcc 0
26 mol 285 unq 1 iso 0 dist 5.77107 6.44657 4.16039 9.78456 8.12306 12.0919 numMergedOcc 0
