0 mol 28 unq 0 iso 0 dist 8.24316 6.76158 11.1346 11.2165 18.2821 8.96154 numMergedOcc 0
1 mol 28 unq 1 iso 0 dist 8.24316 7.423 10.8275 11.2165 18.2821 8.90935 numMergedOcc 0
2 mol 59 unq 0 iso 0 dist 8.82919 4.74574 9.25177 7.87554 16.0484 7.54389 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 6.31934 8.1717 7.31044 4.66383 8.22018 5.83263 numMergedOcc 0
4 mol 68 unq 0 iso 0 dist 5.68303 6.82511 5.08181 6.17121 9.00217 8.32093 numMergedOcc 0
5 mol 81 unq 0 iso 0 dist 5.14604 7.94697 4.95944 3.89012 4.71246 5.2168 numMergedOcc 0
6 mol 211 unq 0 iso 0 dist 7.49132 7.78316 9.54726 3.83887 11.2728 9.08278 numMergedOcc 0
7 mol 220 unq 0 iso 0 dist 8.17723 7.39043 5.05766 8.2608 12.1968 8.15802 numMergedOcc 0
8 mol 236 unq 0 iso 0 dist 6.25412 8.32786 5.50882 3.55894 8.67209 8.69082 numMergedOcc 0
9 mol 236 unq 1 iso 0 dist 6.25412 5.09952 7.27142 3.55894 8.67209 8.2521 numMergedOcc 0
10 mol 258 unq 0 iso 0 dist 5.50553 8.86773 6.4179 6.84145 7.7033 5.3772 numMergedOcc 0
11 mol 258 unq 1 iso 0 dist 5.50553 8.86773 6.4179 17.1265 14.0432 8.70007 numMergedOcc 0
12 mol 258 unq 2 iso 0 dist 5.50553 8.95095 11.4354 6.84145 7.7033 7.59138 numMergedOcc 0
13 mol 266 unq 0 iso 0 dist 9.51286 7.36685 7.52317 11.735 9.27812 8.53393 numMergedOcc 0
14 mol 266 unq 1 iso 0 dist 9.51286 9.03099 9.52953 11.735 9.27812 7.24165 numMergedOcc 0
