0 mol 10 unq 0 iso 0 dist 9.10885 8.01898 8.06428 16.9907 12.5246 9.78153 24.8066 18.9112 17.1926 8.99402 numMergedOcc 0
1 mol 42 unq 0 iso 0 dist 8.03678 12.4373 9.39402 15.6131 10.1829 5.52834 15.8013 14.4319 5.21506 8.84148 numMergedOcc 0
2 mol 42 unq 1 iso 0 dist 8.7885 10.9827 9.39402 15.2296 10.1829 5.52834 14.1419 14.4319 5.21506 8.84148 numMergedOcc 0
3 mol 148 unq 0 iso 0 dist 7.91749 6.76353 9.0735 6.72591 8.03052 9.18753 7.50382 14.9179 11.8278 9.71692 numMergedOcc 0
4 mol 150 unq 0 iso 0 dist 7.96309 6.65519 9.03593 6.80192 8.06512 9.15244 7.48524 14.9398 11.6537 9.73708 numMergedOcc 0
5 mol 158 unq 0 iso 0 dist 4.80508 8.67293 9.98554 10.8796 12.6695 9.96635 12.212 15.9309 10.9312 7.07348 numMergedOcc 0
6 mol 165 unq 0 iso 0 dist 6.4503 5.73847 8.00005 5.04534 6.22764 7.21397 6.58447 4.63353 10.5947 8.2197 numMergedOcc 0
7 mol 192 unq 0 iso 0 dist 8.42665 4.64973 7.97601 9.67207 9.82858 6.2016 8.0557 13.0939 5.21255 7.30965 numMergedOcc 0
8 mol 266 unq 0 iso 0 dist 9.02396 10.9946 6.39822 16.4848 7.52317 9.0836 21.4953 13.6284 16.492 9.77392 numMergedOcc 0
9 mol 266 unq 1 iso 0 dist 9.02396 13.3166 8.61077 16.4848 7.52317 9.62494 21.4953 13.6284 18.9489 9.77392 numMergedOcc 0
10 mol 266 unq 2 iso 0 dist 7.48115 10.9946 5.36518 16.4848 9.52953 9.0836 21.4953 14.9038 16.492 9.77392 numMergedOcc 0
11 mol 266 unq 3 iso 0 dist 7.48115 13.3166 9.11585 16.4848 9.52953 9.62494 21.4953 14.9038 18.9489 9.77392 numMergedOcc 0
12 mol 277 unq 0 iso 0 dist 9.00122 16.2697 9.07744 22.1711 14.4215 6.66936 21.3719 13.4083 5.95045 6.23539 numMergedOcc 0
13 mol 282 unq 0 iso 0 dist 8.36459 5.668 7.21879 6.15396 4.4471 5.00258 5.46739 11.9006 9.80233 8.61456 numMergedOcc 0
14 mol 282 unq 1 iso 0 dist 8.36459 5.668 7.21879 9.18964 10.1631 8.22117 5.46739 11.9006 9.80233 8.41041 numMergedOcc 0
15 mol 282 unq 2 iso 0 dist 9.02882 10.2055 9.60384 12.4657 12.5442 9.98886 12.9302 13.4825 4.68809 8.61456 numMergedOcc 0
16 mol 282 unq 3 iso 0 dist 9.02882 10.2055 9.60384 10.1184 7.00145 6.81887 12.9302 13.4825 4.68809 8.41041 numMergedOcc 0
