0 mol 7 unq 0 iso 0 dist 9.84857 7.62195 8.41173 14.3693 13.1033 9.96415 numMergedOcc 0
1 mol 10 unq 0 iso 0 dist 7.99404 9.87224 7.3489 6.50444 5.04413 7.74463 numMergedOcc 0
2 mol 38 unq 0 iso 0 dist 9.94799 8.40505 5.86972 12.2101 5.31226 7.17698 numMergedOcc 0
3 mol 38 unq 1 iso 0 dist 9.94799 8.40505 5.86972 11.8162 4.57886 4.74069 numMergedOcc 0
4 mol 76 unq 0 iso 0 dist 9.06225 8.04327 7.02854 13.408 8.66335 6.14248 numMergedOcc 0
5 mol 128 unq 0 iso 0 dist 5.4772 6.22373 8.94995 7.95999 8.13018 9.66537 numMergedOcc 0
6 mol 128 unq 1 iso 0 dist 7.84607 7.99353 8.94995 11.4156 8.13018 9.66537 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 8.63018 5.0466 7.07421 11.4776 5.04019 9.31543 numMergedOcc 0
8 mol 129 unq 1 iso 0 dist 8.63018 5.0466 7.07421 8.09774 4.79473 8.85652 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 6.85651 14.0828 7.50126 10.2321 5.30466 5.9959 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 7.03858 11.5586 7.50126 10.9863 5.30466 5.9959 numMergedOcc 0
11 mol 133 unq 2 iso 0 dist 5.68599 5.57746 5.12189 9.76097 6.95933 5.9959 numMergedOcc 0
12 mol 134 unq 0 iso 0 dist 9.49104 8.22726 5.33543 9.13697 4.56331 5.20195 numMergedOcc 0
13 mol 162 unq 0 iso 0 dist 8.77869 15.3374 8.954 13.7027 5.09521 6.51243 numMergedOcc 0
14 mol 219 unq 0 iso 0 dist 9.52151 7.00921 4.67452 9.74779 5.05436 8.3704 numMergedOcc 0
15 mol 226 unq 0 iso 0 dist 8.10096 6.92911 7.20862 14.8729 13.7904 8.31266 numMergedOcc 0
16 mol 230 unq 0 iso 0 dist 8.74076 5.06139 6.23346 11.4118 12.4865 9.3974 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 9.46728 4.13744 5.57184 10.3256 5.45774 6.5311 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 9.46728 4.13744 5.57184 8.56975 12.4194 9.67281 numMergedOcc 0
19 mol 239 unq 0 iso 0 dist 8.68803 6.54316 9.59937 7.96523 3.80345 7.98794 numMergedOcc 0
20 mol 259 unq 0 iso 0 dist 7.97113 6.92619 8.91916 4.95855 10.2743 8.40328 numMergedOcc 0
21 mol 259 unq 1 iso 0 dist 7.97113 6.92619 8.91916 7.72489 11.46 8.2518 numMergedOcc 0
22 mol 259 unq 2 iso 0 dist 5.22111 6.92619 4.55368 4.95855 7.06301 8.40328 numMergedOcc 0
23 mol 259 unq 3 iso 0 dist 5.22111 6.92619 4.55368 7.72489 7.80863 8.2518 numMergedOcc 0
24 mol 259 unq 4 iso 0 dist 8.38479 11.3266 8.91916 9.18435 10.2743 8.40328 numMergedOcc 0
25 mol 259 unq 5 iso 0 dist 8.38479 11.3266 8.91916 12.3606 11.46 8.2518 numMergedOcc 0
26 mol 259 unq 6 iso 0 dist 8.53598 11.3266 4.55368 9.18435 7.06301 8.40328 numMergedOcc 0
27 mol 259 unq 7 iso 0 dist 8.53598 11.3266 4.55368 12.3606 7.80863 8.2518 numMergedOcc 0
28 mol 279 unq 0 iso 0 dist 9.71653 6.05412 8.57035 11.3536 7.23238 7.03656 numMergedOcc 0
29 mol 283 unq 0 iso 0 dist 7.90132 5.37953 7.53773 13.7785 14.4652 9.83098 numMergedOcc 0
