0 mol 10 unq 0 iso 0 dist 8.33546 9.59744 8.12738 12.6064 14.3304 7.30932 12.6452 10.2455 6.62276 7.5169 numMergedOcc 0
1 mol 37 unq 0 iso 0 dist 8.28713 6.32052 6.96814 10.2809 12.917 8.5893 11.2445 9.41747 6.15909 6.84257 numMergedOcc 0
2 mol 37 unq 1 iso 0 dist 8.28713 6.32052 6.96814 10.2809 12.917 8.5893 14.2695 11.8123 12.5114 9.21102 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 8.38139 9.07283 3.42062 11.6226 8.06519 7.32699 13.0498 4.69243 5.81633 8.87951 numMergedOcc 0
4 mol 96 unq 0 iso 0 dist 6.89038 8.6548 6.0108 9.20656 9.63062 7.68964 14.0002 9.09553 9.28941 9.06717 numMergedOcc 0
5 mol 96 unq 1 iso 0 dist 6.89038 8.6548 6.0108 9.20656 9.63062 7.68964 16.7386 12.9876 9.9118 9.579 numMergedOcc 0
6 mol 124 unq 0 iso 0 dist 7.24083 8.06631 6.49874 5.20968 11.6778 9.66083 8.45451 9.3565 5.3096 8.03603 numMergedOcc 0
7 mol 239 unq 0 iso 0 dist 9.64578 7.45508 9.1722 4.30527 12.9398 7.14918 9.19442 15.2068 11.6389 8.92121 numMergedOcc 0
8 mol 239 unq 1 iso 0 dist 9.64578 5.79883 11.457 4.30527 12.9398 9.29322 9.19442 15.2068 10.1445 8.92121 numMergedOcc 0
9 mol 239 unq 2 iso 0 dist 7.02833 7.45508 11.2097 4.30527 9.26044 7.14918 9.19442 5.22517 11.6389 8.92121 numMergedOcc 0
10 mol 239 unq 3 iso 0 dist 7.02833 5.79883 6.10489 4.30527 9.26044 9.29322 9.19442 5.22517 10.1445 8.92121 numMergedOcc 0
11 mol 283 unq 0 iso 0 dist 9.74822 7.17276 9.8348 5.72409 7.11407 9.33601 10.6835 4.88654 9.76279 6.53354 numMergedOcc 0
12 mol 283 unq 1 iso 0 dist 9.74822 7.17276 9.8348 5.72409 7.11407 9.33601 8.57375 11.4035 7.97597 6.93798 numMergedOcc 0
13 mol 287 unq 0 iso 0 dist 5.06731 6.05363 3.76412 13.3584 8.85872 9.2144 14.1776 9.44841 9.21351 7.58907 numMergedOcc 0
14 mol 288 unq 0 iso 0 dist 5.06731 6.05363 3.76412 13.3584 8.85872 9.2144 14.1776 9.44841 9.21351 7.58907 numMergedOcc 0
15 mol 289 unq 0 iso 0 dist 5.06731 6.05363 3.76412 13.3584 8.85872 9.2144 14.1776 9.44841 9.21351 7.58907 numMergedOcc 0
