0 mol 59 unq 0 iso 0 dist 5.41134 6.65344 6.34748 5.29688 9.05547 6.85766 5.96516 8.185 12.3053 10.1462 numMergedOcc 0
1 mol 59 unq 1 iso 0 dist 8.61357 9.59244 7.43198 12.0007 9.05547 16.1832 7.53537 8.185 11.095 10.1462 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 5.73908 7.51075 13.0823 13.4703 9.7754 20.0174 7.27578 5.26566 13.5465 6.60361 numMergedOcc 0
3 mol 68 unq 1 iso 0 dist 5.73908 7.51075 13.0823 13.4703 9.7754 20.0174 5.66182 6.27118 11.8668 9.64558 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 8.09675 8.67532 6.97502 14.4838 9.89021 16.8583 11.1342 9.85386 15.8501 6.28792 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 8.09675 8.67532 6.97502 14.4838 9.89021 16.8583 8.22845 4.8983 8.62079 10.8482 numMergedOcc 0
6 mol 88 unq 0 iso 0 dist 5.74637 7.74197 13.1838 4.0486 7.76275 9.36773 4.56066 5.6516 10.7263 6.27514 numMergedOcc 0
7 mol 88 unq 1 iso 0 dist 5.74637 7.86537 12.6939 4.0486 7.76275 8.31336 4.56066 5.6516 12.2051 6.27514 numMergedOcc 0
8 mol 88 unq 2 iso 0 dist 5.74637 6.35462 6.63027 4.0486 7.76275 10.3436 4.56066 5.6516 7.74064 6.27514 numMergedOcc 0
9 mol 175 unq 0 iso 0 dist 7.7013 8.58906 5.52686 12.3666 6.73365 12.0591 3.47137 8.06007 9.32259 12.5746 numMergedOcc 0
10 mol 175 unq 1 iso 0 dist 7.7013 8.58906 5.52686 12.3067 9.45659 14.3157 3.47137 8.06007 9.32259 13.5565 numMergedOcc 0
11 mol 175 unq 2 iso 0 dist 7.7013 8.58906 5.52686 7.28603 9.44856 13.1497 3.47137 8.06007 9.32259 9.03819 numMergedOcc 0
12 mol 272 unq 0 iso 0 dist 7.38085 9.64596 4.78295 5.26991 8.82094 8.48753 3.64298 9.87477 11.7109 4.95884 numMergedOcc 0
13 mol 274 unq 0 iso 0 dist 6.28023 9.09967 5.7574 4.4049 9.81087 10.3851 7.72539 8.67957 13.0817 10.7853 numMergedOcc 0
14 mol 274 unq 1 iso 0 dist 6.28023 8.49076 7.23876 4.4049 9.81087 12.8531 7.72539 8.67957 8.12739 10.7853 numMergedOcc 0
15 mol 277 unq 0 iso 0 dist 6.70414 9.29635 5.77904 14.2115 9.84188 12.5685 7.31817 4.1545 4.9764 13.7583 numMergedOcc 0
16 mol 277 unq 1 iso 0 dist 6.70414 9.29635 5.77904 14.2115 9.84188 12.5685 3.91224 4.25172 6.36559 13.6433 numMergedOcc 0
17 mol 277 unq 2 iso 0 dist 6.70414 9.29635 5.77904 10.8075 8.35794 9.7748 7.31817 4.1545 4.9764 11.8607 numMergedOcc 0
18 mol 277 unq 3 iso 0 dist 6.70414 9.29635 5.77904 10.8075 8.35794 9.7748 3.91224 4.25172 6.36559 10.9137 numMergedOcc 0
19 mol 287 unq 0 iso 0 dist 7.47179 7.26542 5.10722 11.3154 7.13655 11.3696 5.42266 8.73403 9.76232 8.77521 numMergedOcc 0
20 mol 288 unq 0 iso 0 dist 7.47179 7.26542 5.10722 11.3154 7.13655 11.3696 5.42266 8.73403 9.76232 8.77521 numMergedOcc 0
21 mol 289 unq 0 iso 0 dist 7.47179 7.26542 5.10722 11.3154 7.13655 11.3696 5.42266 8.73403 9.76232 8.77521 numMergedOcc 0
22 mol 293 unq 0 iso 0 dist 6.97887 9.55282 5.67215 8.40114 8.78835 13.3844 5.93756 7.15948 12.2975 6.11795 numMergedOcc 0
23 mol 293 unq 1 iso 0 dist 6.97887 6.27435 11.4201 8.40114 8.78835 12.7742 5.93756 7.15948 12.108 6.11795 numMergedOcc 0
