0 mol 73 unq 0 iso 0 dist 6.4154 10.8619 6.96647 10.4716 8.70133 4.78435 numMergedOcc 0
1 mol 73 unq 1 iso 0 dist 6.4154 10.8619 6.96647 8.04817 5.64598 4.60412 numMergedOcc 0
2 mol 73 unq 2 iso 0 dist 6.4154 10.8619 6.96647 5.2774 4.65521 6.33833 numMergedOcc 0
3 mol 86 unq 0 iso 0 dist 9.54683 5.9581 6.13833 4.98527 7.79359 7.89966 numMergedOcc 0
4 mol 88 unq 0 iso 0 dist 7.19209 7.94533 7.11852 7.70573 9.10189 14.0389 numMergedOcc 0
5 mol 133 unq 0 iso 0 dist 8.25207 14.4989 7.46812 14.4683 7.92688 11.0256 numMergedOcc 0
6 mol 173 unq 0 iso 0 dist 9.25763 18.0021 9.71921 15.2665 7.93331 4.98931 numMergedOcc 0
7 mol 173 unq 1 iso 0 dist 9.25763 18.0021 9.71921 12.006 6.98095 7.47584 numMergedOcc 0
8 mol 173 unq 2 iso 0 dist 9.25763 18.0021 9.71921 14.7376 8.31897 9.50929 numMergedOcc 0
9 mol 173 unq 3 iso 0 dist 9.63102 17.8768 9.71921 14.1226 7.93331 4.98931 numMergedOcc 0
10 mol 173 unq 4 iso 0 dist 9.63102 17.8768 9.71921 11.6705 6.98095 7.47584 numMergedOcc 0
11 mol 173 unq 5 iso 0 dist 9.63102 17.8768 9.71921 12.3698 8.31897 9.50929 numMergedOcc 0
12 mol 224 unq 0 iso 0 dist 8.77324 4.52111 7.26162 5.19217 8.19953 8.00193 numMergedOcc 0
13 mol 224 unq 1 iso 0 dist 8.60781 9.9943 9.89345 5.63485 6.87664 12.8561 numMergedOcc 0
14 mol 228 unq 0 iso 0 dist 9.58356 16.9383 8.2286 6.29965 8.06181 12.8654 numMergedOcc 0
15 mol 228 unq 1 iso 0 dist 9.58356 16.9383 8.2286 10.5936 8.38048 9.81 numMergedOcc 0
16 mol 228 unq 2 iso 0 dist 9.58356 16.9383 8.2286 14.6816 7.65132 5.34643 numMergedOcc 0
17 mol 228 unq 3 iso 0 dist 9.58356 16.9383 8.2286 6.01863 8.53764 14.0156 numMergedOcc 0
18 mol 228 unq 4 iso 0 dist 9.29522 17.1358 8.5965 6.30523 7.77367 13.0265 numMergedOcc 0
19 mol 228 unq 5 iso 0 dist 9.29522 17.1358 8.5965 10.5683 8.20909 10.0235 numMergedOcc 0
20 mol 228 unq 6 iso 0 dist 9.29522 17.1358 8.5965 14.9669 7.94506 5.34702 numMergedOcc 0
21 mol 228 unq 7 iso 0 dist 9.29522 17.1358 8.5965 6.21036 8.15494 14.0419 numMergedOcc 0
22 mol 274 unq 0 iso 0 dist 5.12523 6.66404 9.01371 5.1874 7.97444 6.88138 numMergedOcc 0
23 mol 293 unq 0 iso 0 dist 7.59622 6.80673 9.94817 6.85131 9.97212 10.5736 numMergedOcc 0
24 mol 294 unq 0 iso 0 dist 7.82457 15.5673 9.13209 15.0262 7.34205 5.15462 numMergedOcc 0
