0 mol 10 unq 0 iso 0 dist 7.47015 7.36963 3.92592 8.57339 5.59965 6.18431 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 7.98414 9.16481 13.2652 10.6064 8.5315 19.1241 numMergedOcc 0
2 mol 79 unq 0 iso 0 dist 7.54919 7.56 5.76452 11.0544 6.78004 11.225 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 8.21272 8.25027 16.0555 5.30646 6.84835 13.087 numMergedOcc 0
4 mol 133 unq 1 iso 0 dist 8.21272 8.25027 16.0555 14.1825 8.42748 22.3997 numMergedOcc 0
5 mol 171 unq 0 iso 0 dist 8.53734 7.87612 11.4427 13.6177 5.25109 15.954 numMergedOcc 0
6 mol 171 unq 1 iso 0 dist 8.53734 7.87612 11.4427 16.0184 8.21618 19.5075 numMergedOcc 0
7 mol 171 unq 2 iso 0 dist 6.08141 5.98495 4.88147 9.13275 5.25109 5.74846 numMergedOcc 0
8 mol 171 unq 3 iso 0 dist 6.08141 5.98495 4.88147 11.3808 8.21618 9.37868 numMergedOcc 0
9 mol 181 unq 0 iso 0 dist 9.89987 9.24772 6.39406 5.16569 7.32087 7.35884 numMergedOcc 0
10 mol 181 unq 1 iso 0 dist 9.89987 9.24772 6.39406 14.8476 8.86197 11.6588 numMergedOcc 0
11 mol 196 unq 0 iso 0 dist 4.83135 9.95371 11.8216 4.45798 7.21349 13.983 numMergedOcc 0
12 mol 232 unq 0 iso 0 dist 8.70651 7.13253 4.68548 14.8728 9.78181 13.6374 numMergedOcc 0
13 mol 232 unq 1 iso 0 dist 8.70651 7.13253 4.68548 4.03628 9.8664 6.59036 numMergedOcc 0
14 mol 260 unq 0 iso 0 dist 7.23618 7.97307 9.07649 5.72956 9.32954 6.75725 numMergedOcc 0
15 mol 260 unq 1 iso 0 dist 7.23618 8.52702 14.885 5.72956 9.32954 12.6653 numMergedOcc 0
16 mol 266 unq 0 iso 0 dist 6.99089 8.6959 12.359 4.82331 7.00243 13.4867 numMergedOcc 0
17 mol 277 unq 0 iso 0 dist 9.76241 7.98589 6.64795 13.203 8.20644 12.5241 numMergedOcc 0
