0 mol 10 unq 0 iso 0 dist 8.61887 9.39886 3.58347 9.6581 9.00506 10.4052 numMergedOcc 0
1 mol 10 unq 1 iso 0 dist 6.77277 9.75001 9.40985 6.68744 6.94628 3.25792 numMergedOcc 0
2 mol 10 unq 2 iso 0 dist 6.77277 9.06457 10.9618 6.68744 6.94628 4.68389 numMergedOcc 0
3 mol 88 unq 0 iso 0 dist 9.3278 5.9443 8.67102 9.27633 6.50926 5.06277 numMergedOcc 0
4 mol 88 unq 1 iso 0 dist 9.3278 5.9443 8.67102 7.59715 9.85837 5.46288 numMergedOcc 0
5 mol 88 unq 2 iso 0 dist 9.3278 9.16708 11.5214 9.27633 6.50926 8.77344 numMergedOcc 0
6 mol 88 unq 3 iso 0 dist 9.3278 9.16708 11.5214 7.59715 9.85837 3.13774 numMergedOcc 0
7 mol 101 unq 0 iso 0 dist 7.42633 9.85715 3.73374 8.83779 4.97717 7.5541 numMergedOcc 0
8 mol 211 unq 0 iso 0 dist 8.39205 6.69877 4.09875 8.54189 6.17004 4.83618 numMergedOcc 0
9 mol 239 unq 0 iso 0 dist 9.40943 8.9327 11.1207 7.01673 11.6389 3.13463 numMergedOcc 0
10 mol 247 unq 0 iso 0 dist 6.32156 7.95874 3.42642 9.42253 11.6852 14.312 numMergedOcc 0
11 mol 260 unq 0 iso 0 dist 8.28805 7.4261 9.49851 8.43724 11.1908 9.98348 numMergedOcc 0
12 mol 283 unq 0 iso 0 dist 8.63928 9.60873 7.87842 8.91437 9.76279 3.12129 numMergedOcc 0
13 mol 287 unq 0 iso 0 dist 8.05825 9.5356 3.85958 9.7875 5.03775 8.54063 numMergedOcc 0
14 mol 287 unq 1 iso 0 dist 7.92464 9.9229 10.5401 7.81225 5.15725 5.55422 numMergedOcc 0
15 mol 287 unq 2 iso 0 dist 8.69031 9.9229 11.2595 7.81225 7.46917 5.55422 numMergedOcc 0
16 mol 288 unq 0 iso 0 dist 8.05825 9.5356 3.85958 9.7875 5.03775 8.54063 numMergedOcc 0
17 mol 288 unq 1 iso 0 dist 7.92464 9.9229 10.5401 7.81225 5.15725 5.55422 numMergedOcc 0
18 mol 288 unq 2 iso 0 dist 8.69031 9.9229 11.2595 7.81225 7.46917 5.55422 numMergedOcc 0
19 mol 289 unq 0 iso 0 dist 8.05825 9.5356 3.85958 9.7875 5.03775 8.54063 numMergedOcc 0
20 mol 289 unq 1 iso 0 dist 7.92464 9.9229 10.5401 7.81225 5.15725 5.55422 numMergedOcc 0
21 mol 289 unq 2 iso 0 dist 8.69031 9.9229 11.2595 7.81225 7.46917 5.55422 numMergedOcc 0
