0 mol 2 unq 0 iso 0 dist 6.60948 10.6853 9.57674 8.5521 7.93028 11.2848 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 7.87317 4.38622 6.40741 12.8358 9.45239 10.8237 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 7.87317 7.06386 9.31366 12.8358 9.45239 9.4466 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 8.02004 4.28801 7.78475 5.30529 9.07969 5.61827 numMergedOcc 0
4 mol 48 unq 1 iso 0 dist 8.02004 4.28801 7.78475 6.60498 9.61448 8.4772 numMergedOcc 0
5 mol 48 unq 2 iso 0 dist 6.35042 7.07335 7.78475 9.66291 9.07969 5.61827 numMergedOcc 0
6 mol 48 unq 3 iso 0 dist 6.35042 7.07335 7.78475 11.8666 9.61448 8.4772 numMergedOcc 0
7 mol 48 unq 4 iso 0 dist 7.77714 4.31769 6.99001 5.41436 8.94842 5.20775 numMergedOcc 0
8 mol 48 unq 5 iso 0 dist 7.77714 4.31769 6.99001 6.53592 9.9555 8.11954 numMergedOcc 0
9 mol 48 unq 6 iso 0 dist 6.46118 7.10894 6.99001 9.58119 8.94842 5.20775 numMergedOcc 0
10 mol 48 unq 7 iso 0 dist 6.46118 7.10894 6.99001 12.1293 9.9555 8.11954 numMergedOcc 0
11 mol 63 unq 0 iso 0 dist 7.76044 5.93871 9.22331 3.79852 8.77624 6.23298 numMergedOcc 0
12 mol 68 unq 0 iso 0 dist 8.56412 6.52256 6.34966 5.44435 7.95428 9.87177 numMergedOcc 0
13 mol 68 unq 1 iso 0 dist 8.56412 6.52256 6.34966 4.67591 5.88256 7.71726 numMergedOcc 0
14 mol 89 unq 0 iso 0 dist 6.54089 4.3307 9.67681 8.39998 8.68698 8.7306 numMergedOcc 0
15 mol 184 unq 0 iso 0 dist 8.57284 5.2978 5.0207 10.2602 9.16535 10.6777 numMergedOcc 0
16 mol 184 unq 1 iso 0 dist 5.34832 7.00807 5.0207 4.06422 9.16535 10.6777 numMergedOcc 0
17 mol 192 unq 0 iso 0 dist 8.3311 5.53163 8.96522 6.3479 7.578 6.61715 numMergedOcc 0
18 mol 192 unq 1 iso 0 dist 8.3311 9.95307 7.04366 6.3479 7.578 6.01624 numMergedOcc 0
19 mol 192 unq 2 iso 0 dist 8.3311 17.4871 9.99783 6.3479 7.578 13.4418 numMergedOcc 0
20 mol 192 unq 3 iso 0 dist 7.6168 6.3552 9.78825 6.3479 9.24926 7.30566 numMergedOcc 0
21 mol 192 unq 4 iso 0 dist 7.74423 7.82232 8.96522 10.6544 7.578 6.61715 numMergedOcc 0
22 mol 192 unq 5 iso 0 dist 7.74423 5.97774 7.04366 10.6544 7.578 6.01624 numMergedOcc 0
23 mol 192 unq 6 iso 0 dist 7.74423 11.5774 9.99783 10.6544 7.578 13.4418 numMergedOcc 0
24 mol 210 unq 0 iso 0 dist 8.14413 15.9012 8.87054 10.2478 9.11574 10.1113 numMergedOcc 0
25 mol 243 unq 0 iso 0 dist 8.82073 5.70601 5.98438 5.70397 7.89993 7.64155 numMergedOcc 0
26 mol 247 unq 0 iso 0 dist 9.69819 5.97116 9.9667 16.3156 7.95874 14.8141 numMergedOcc 0
27 mol 256 unq 0 iso 0 dist 6.07677 3.9298 8.56128 4.80469 8.89351 8.0737 numMergedOcc 0
28 mol 256 unq 1 iso 0 dist 7.56605 7.37784 8.56128 4.07811 8.89351 8.0737 numMergedOcc 0
