0 mol 26 unq 0 iso 0 dist 8.44506 7.98005 12.4814 7.11305 6.38243 8.97754 11.9684 5.66783 12.5394 6.81793 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.44506 8.31381 15.4838 7.11305 6.38243 13.5629 11.9684 5.66783 17.602 6.81793 numMergedOcc 0
2 mol 92 unq 0 iso 0 dist 6.61823 8.85601 13.129 5.31547 6.98037 10.9088 9.75237 8.67827 17.3255 6.59716 numMergedOcc 0
3 mol 92 unq 1 iso 0 dist 6.61823 8.85601 13.129 4.3481 6.9223 13.1158 9.75237 8.67827 17.3255 6.87506 numMergedOcc 0
4 mol 92 unq 2 iso 0 dist 6.49956 8.85601 12.8901 4.3481 7.0561 13.1158 9.75237 13.0818 17.3255 6.87506 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 7.26086 7.92856 8.67903 3.9764 8.75597 11.36 11.3043 8.02554 14.0839 9.84703 numMergedOcc 0
6 mol 98 unq 1 iso 0 dist 7.26086 7.92856 8.67903 3.9764 8.75597 11.36 6.65501 11.2092 11.6496 4.62494 numMergedOcc 0
7 mol 112 unq 0 iso 0 dist 6.43433 6.87434 4.25001 10.5563 5.43933 9.24706 11.5768 5.91698 7.45152 7.67238 numMergedOcc 0
8 mol 112 unq 1 iso 0 dist 6.43433 6.87434 4.25001 6.75738 7.44041 10.3476 12.9739 15.0784 16.6124 8.72725 numMergedOcc 0
9 mol 131 unq 0 iso 0 dist 9.29384 8.80895 9.6795 12.6005 6.78801 14.4726 14.9021 5.66194 13.2414 7.75314 numMergedOcc 0
10 mol 141 unq 0 iso 0 dist 6.69515 7.46621 10.7652 13.2918 6.77921 15.9403 11.0743 5.38571 15.4031 6.65731 numMergedOcc 0
11 mol 143 unq 0 iso 0 dist 7.25673 8.99891 12.6218 4.78563 8.612 12.5751 7.78652 6.60479 14.3396 5.06564 numMergedOcc 0
12 mol 143 unq 1 iso 0 dist 7.25673 8.99891 12.6218 4.78563 8.612 12.5751 8.91301 7.54337 12.476 7.5373 numMergedOcc 0
13 mol 194 unq 0 iso 0 dist 6.26839 9.52922 7.82899 10.0756 5.53324 4.45769 8.65535 5.92931 3.7326 4.19371 numMergedOcc 0
14 mol 194 unq 1 iso 0 dist 6.26839 9.52922 7.82899 11.8031 6.72182 12.9621 12.4952 7.50057 12.7379 9.00322 numMergedOcc 0
15 mol 195 unq 0 iso 0 dist 6.60567 6.59544 11.5264 5.41635 6.34234 10.4086 7.36683 6.0634 9.10355 6.22742 numMergedOcc 0
16 mol 195 unq 1 iso 0 dist 6.60567 6.59544 11.5264 11.9954 7.87972 18.2938 17.8873 11.4252 22.7756 9.24936 numMergedOcc 0
17 mol 266 unq 0 iso 0 dist 7.71657 8.97531 5.48178 4.74189 8.20485 9.83672 10.1085 8.62248 13.8751 9.63518 numMergedOcc 0
