0 mol 24 unq 0 iso 0 dist 4.78749 6.44893 10.6642 5.42968 10.0962 4.21283 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 4.78749 6.44893 10.6642 5.94343 8.56474 4.97191 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 9.26484 9.33262 14.3985 9.87737 7.49197 16.6291 numMergedOcc 0
3 mol 70 unq 1 iso 0 dist 9.26484 9.33262 14.3985 6.7303 5.22165 13.2887 numMergedOcc 0
4 mol 83 unq 0 iso 0 dist 9.48319 9.93908 14.0049 7.88265 8.73538 6.97032 numMergedOcc 0
5 mol 109 unq 0 iso 0 dist 7.6886 8.39026 12.5938 8.85675 5.21343 9.65072 numMergedOcc 0
6 mol 128 unq 0 iso 0 dist 8.20904 7.03633 12.0449 9.00141 4.17039 13.0042 numMergedOcc 0
7 mol 128 unq 1 iso 0 dist 8.20904 7.03633 12.0449 4.26814 8.12949 4.21194 numMergedOcc 0
8 mol 128 unq 2 iso 0 dist 9.82711 7.90691 12.0449 7.66528 8.12949 4.21194 numMergedOcc 0
9 mol 128 unq 3 iso 0 dist 9.82711 8.83011 15.6064 7.66528 8.12949 9.46982 numMergedOcc 0
10 mol 128 unq 4 iso 0 dist 7.94925 9.23513 14.0488 7.12662 9.52999 7.698 numMergedOcc 0
11 mol 128 unq 5 iso 0 dist 7.94925 9.23513 14.0488 9.38 8.12622 12.5502 numMergedOcc 0
12 mol 130 unq 0 iso 0 dist 8.65807 9.36312 5.32363 6.90456 7.40105 3.91348 numMergedOcc 0
13 mol 188 unq 0 iso 0 dist 9.88722 8.14959 14.5692 9.81333 14.8075 11.578 numMergedOcc 0
14 mol 189 unq 0 iso 0 dist 8.01521 9.5853 8.53414 8.49359 9.15913 8.73039 numMergedOcc 0
15 mol 195 unq 0 iso 0 dist 8.3941 8.22643 9.48981 9.33055 16.9491 11.5264 numMergedOcc 0
16 mol 206 unq 0 iso 0 dist 9.0815 7.47477 12.4995 7.54599 6.66922 7.13626 numMergedOcc 0
17 mol 206 unq 1 iso 0 dist 7.53036 8.65572 11.8096 8.42431 14.3699 15.8594 numMergedOcc 0
18 mol 206 unq 2 iso 0 dist 7.53036 8.39332 10.879 8.42431 14.3699 13.0074 numMergedOcc 0
19 mol 225 unq 0 iso 0 dist 8.33143 6.06105 6.06047 8.81424 10.8002 8.38864 numMergedOcc 0
20 mol 225 unq 1 iso 0 dist 8.33143 6.06105 6.06047 9.60949 16.2766 11.1621 numMergedOcc 0
21 mol 261 unq 0 iso 0 dist 6.93654 5.67349 11.2562 8.55479 4.0136 11.1232 numMergedOcc 0
22 mol 261 unq 1 iso 0 dist 9.66298 5.67349 13.4429 8.55479 4.30068 11.1232 numMergedOcc 0
