0 mol 25 unq 0 iso 0 dist 8.25357 8.34763 7.30471 4.93307 8.61491 5.99176 numMergedOcc 0
1 mol 25 unq 1 iso 0 dist 8.25357 5.66008 6.91789 4.93307 8.61491 6.98583 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 9.66461 7.99735 10.9256 4.31769 8.68989 8.82709 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 8.81136 9.7516 10.9256 7.10894 8.68989 8.82709 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 9.22704 6.00684 10.1574 6.0425 11.625 5.72627 numMergedOcc 0
5 mol 79 unq 1 iso 0 dist 9.22704 6.00684 10.1574 11.8739 15.1951 7.68741 numMergedOcc 0
6 mol 79 unq 2 iso 0 dist 9.22704 6.00684 10.1574 12.1206 18.3866 9.86085 numMergedOcc 0
7 mol 79 unq 3 iso 0 dist 9.22704 6.00684 10.1574 11.9735 11.3356 9.76351 numMergedOcc 0
8 mol 116 unq 0 iso 0 dist 8.49761 5.58346 6.80479 5.27853 7.92221 8.3971 numMergedOcc 0
9 mol 116 unq 1 iso 0 dist 8.49761 7.09179 6.42183 5.27853 7.92221 6.74026 numMergedOcc 0
10 mol 125 unq 0 iso 0 dist 6.31546 9.5205 12.7481 7.15048 9.85979 8.74577 numMergedOcc 0
11 mol 125 unq 1 iso 0 dist 6.31546 7.1608 11.663 4.18419 7.00113 9.94322 numMergedOcc 0
12 mol 125 unq 2 iso 0 dist 6.31546 7.1608 11.663 7.15048 9.85979 9.7728 numMergedOcc 0
13 mol 128 unq 0 iso 0 dist 8.20389 6.49794 8.04676 6.78058 14.3492 9.05678 numMergedOcc 0
14 mol 128 unq 1 iso 0 dist 8.20389 6.49794 8.04676 7.34304 7.61237 8.73383 numMergedOcc 0
15 mol 203 unq 0 iso 0 dist 9.44579 6.79769 5.76556 8.94229 10.7462 8.22927 numMergedOcc 0
16 mol 239 unq 0 iso 0 dist 6.17408 6.70738 10.3685 8.9959 11.0771 8.99609 numMergedOcc 0
17 mol 239 unq 1 iso 0 dist 6.17408 6.70738 10.3685 6.56772 12.2148 8.09656 numMergedOcc 0
18 mol 239 unq 2 iso 0 dist 6.17602 8.55314 10.3685 12.8119 11.0771 8.99609 numMergedOcc 0
19 mol 239 unq 3 iso 0 dist 6.17602 8.55314 10.3685 10.0385 12.2148 8.09656 numMergedOcc 0
20 mol 247 unq 0 iso 0 dist 6.23164 6.97395 7.01958 4.46 6.29945 8.54404 numMergedOcc 0
21 mol 266 unq 0 iso 0 dist 9.4961 7.27283 11.8672 6.33919 12.926 7.53905 numMergedOcc 0
22 mol 266 unq 1 iso 0 dist 8.08479 7.27283 9.91179 6.33919 6.77259 7.53905 numMergedOcc 0
23 mol 266 unq 2 iso 0 dist 7.07099 8.35447 14.7075 10.4141 16.8924 7.53905 numMergedOcc 0
24 mol 266 unq 3 iso 0 dist 8.83873 8.35447 7.79277 10.4141 14.4521 7.53905 numMergedOcc 0
25 mol 266 unq 4 iso 0 dist 8.3978 8.35447 11.8672 10.4141 12.926 7.53905 numMergedOcc 0
26 mol 292 unq 0 iso 0 dist 8.60635 8.17727 6.5975 6.25614 8.67838 9.5144 numMergedOcc 0
