0 mol 0 unq 0 iso 0 dist 9.94618 9.16606 11.4815 8.65478 4.62434 13.4692 numMergedOcc 0
1 mol 4 unq 0 iso 0 dist 8.23852 5.39008 4.46089 9.97548 7.5208 10.0612 numMergedOcc 0
2 mol 28 unq 0 iso 0 dist 9.83168 8.40467 13.4544 8.91922 4.656 9.71507 numMergedOcc 0
3 mol 37 unq 0 iso 0 dist 5.98359 9.21102 4.23663 8.5893 12.0017 12.5114 numMergedOcc 0
4 mol 37 unq 1 iso 0 dist 5.98359 6.84257 8.49523 8.5893 12.0017 6.15909 numMergedOcc 0
5 mol 43 unq 0 iso 0 dist 8.58709 7.67459 8.75469 7.80117 5.46849 3.83842 numMergedOcc 0
6 mol 43 unq 1 iso 0 dist 7.53564 7.62469 6.44784 9.79386 5.46849 10.7481 numMergedOcc 0
7 mol 54 unq 0 iso 0 dist 6.10175 6.29755 12.1689 9.63616 7.25076 15.2635 numMergedOcc 0
8 mol 54 unq 1 iso 0 dist 6.10175 7.4038 11.8364 9.63616 7.25076 16.9039 numMergedOcc 0
9 mol 90 unq 0 iso 0 dist 8.6308 7.94379 5.12529 8.96446 3.78122 6.65219 numMergedOcc 0
10 mol 98 unq 0 iso 0 dist 8.87856 7.88143 6.62867 8.73798 11.2684 13.2666 numMergedOcc 0
11 mol 98 unq 1 iso 0 dist 8.87856 6.62952 11.2334 8.73798 11.2684 8.734 numMergedOcc 0
12 mol 98 unq 2 iso 0 dist 6.2491 7.88143 12.7928 8.73798 4.05759 13.2666 numMergedOcc 0
13 mol 98 unq 3 iso 0 dist 6.2491 6.62952 7.89992 8.73798 4.05759 8.734 numMergedOcc 0
14 mol 98 unq 4 iso 0 dist 3.59451 4.3521 7.89992 5.24616 4.05759 8.734 numMergedOcc 0
15 mol 101 unq 0 iso 0 dist 9.1109 7.11476 4.39441 6.54699 5.42817 6.43467 numMergedOcc 0
16 mol 101 unq 1 iso 0 dist 5.51185 7.11476 4.84084 6.54699 4.19577 6.43467 numMergedOcc 0
17 mol 124 unq 0 iso 0 dist 5.61764 8.03603 5.26643 9.66083 8.5036 5.3096 numMergedOcc 0
18 mol 175 unq 0 iso 0 dist 8.39634 8.09309 10.2448 7.19751 10.8953 3.92978 numMergedOcc 0
19 mol 184 unq 0 iso 0 dist 5.13722 8.49577 8.78766 9.511 9.62165 6.83738 numMergedOcc 0
20 mol 184 unq 1 iso 0 dist 5.13722 8.49577 8.78766 7.72354 9.27535 4.57656 numMergedOcc 0
21 mol 193 unq 0 iso 0 dist 5.19654 8.71993 3.53549 6.10013 3.41036 4.8988 numMergedOcc 0
22 mol 209 unq 0 iso 0 dist 8.65539 6.74526 6.04843 9.81506 9.41905 4.19179 numMergedOcc 0
23 mol 209 unq 1 iso 0 dist 8.65539 8.12326 10.2501 9.81506 9.41905 6.28791 numMergedOcc 0
24 mol 210 unq 0 iso 0 dist 7.68078 8.94889 12.3142 8.44451 6.36429 7.85817 numMergedOcc 0
25 mol 210 unq 1 iso 0 dist 9.26518 8.94889 13.7365 8.44451 13.4995 7.85817 numMergedOcc 0
26 mol 239 unq 0 iso 0 dist 8.33254 8.92121 11.8831 7.14918 14.793 11.6389 numMergedOcc 0
27 mol 239 unq 1 iso 0 dist 8.33254 8.92121 11.8831 9.29322 7.07666 10.1445 numMergedOcc 0
28 mol 249 unq 0 iso 0 dist 6.04688 5.70674 4.88298 5.7671 7.19269 4.49386 numMergedOcc 0
29 mol 261 unq 0 iso 0 dist 9.64886 8.96253 14.3335 9.90119 12.0622 4.1492 numMergedOcc 0
30 mol 270 unq 0 iso 0 dist 7.65449 6.32507 5.64329 5.2559 3.53146 4.68028 numMergedOcc 0
31 mol 281 unq 0 iso 0 dist 9.61122 6.47753 10.2905 9.49871 13.0024 4.93084 numMergedOcc 0
32 mol 283 unq 0 iso 0 dist 6.15136 6.53354 6.84734 9.33601 11.413 9.76279 numMergedOcc 0
33 mol 283 unq 1 iso 0 dist 6.15136 6.93798 4.67572 9.33601 11.413 7.97597 numMergedOcc 0
