0 mol 8 unq 0 iso 0 dist 9.36227 8.16743 12.0906 4.81384 13.2172 6.26865 numMergedOcc 0
1 mol 76 unq 0 iso 0 dist 9.4022 8.39101 4.42702 5.72925 11.726 9.46312 numMergedOcc 0
2 mol 114 unq 0 iso 0 dist 8.53731 7.50886 8.32999 9.22317 14.9408 9.86739 numMergedOcc 0
3 mol 114 unq 1 iso 0 dist 8.53731 7.50886 8.32999 10.9258 16.206 8.39249 numMergedOcc 0
4 mol 114 unq 2 iso 0 dist 8.53731 7.50886 8.32999 5.48365 11.8658 8.93623 numMergedOcc 0
5 mol 155 unq 0 iso 0 dist 6.91762 8.02593 4.40049 5.92486 7.62575 7.37901 numMergedOcc 0
6 mol 155 unq 1 iso 0 dist 6.91762 7.62575 5.92486 4.40049 8.02593 7.37901 numMergedOcc 0
7 mol 181 unq 0 iso 0 dist 5.75545 8.45395 6.22085 7.58472 10.5618 8.20656 numMergedOcc 0
8 mol 181 unq 1 iso 0 dist 5.75545 5.41368 4.48609 7.58472 10.5618 9.40622 numMergedOcc 0
9 mol 181 unq 2 iso 0 dist 8.86645 9.15368 6.22085 4.24915 10.5618 8.20656 numMergedOcc 0
10 mol 181 unq 3 iso 0 dist 8.86645 7.96182 4.48609 4.24915 10.5618 9.40622 numMergedOcc 0
11 mol 187 unq 0 iso 0 dist 7.81168 8.26654 13.0397 5.94354 13.5882 7.01496 numMergedOcc 0
12 mol 233 unq 0 iso 0 dist 7.74693 7.83363 5.3674 11.8509 13.7617 9.2911 numMergedOcc 0
13 mol 235 unq 0 iso 0 dist 8.92054 8.19915 5.52698 5.85485 10.648 7.27958 numMergedOcc 0
14 mol 238 unq 0 iso 0 dist 9.51177 9.46582 13.1765 14.0686 13.4351 6.5772 numMergedOcc 0
15 mol 243 unq 0 iso 0 dist 5.86679 6.9453 4.20431 4.12468 8.53888 8.93338 numMergedOcc 0
16 mol 243 unq 1 iso 0 dist 5.86679 8.53888 4.12468 10.4928 10.7436 9.1101 numMergedOcc 0
17 mol 243 unq 2 iso 0 dist 5.86679 8.53888 4.12468 4.20431 6.9453 8.93338 numMergedOcc 0
18 mol 243 unq 3 iso 0 dist 8.28347 6.9453 10.5337 4.12468 9.46855 8.93338 numMergedOcc 0
19 mol 243 unq 4 iso 0 dist 8.28347 9.46855 4.12468 13.8577 10.7436 9.1101 numMergedOcc 0
20 mol 243 unq 5 iso 0 dist 8.28347 9.46855 4.12468 10.5337 6.9453 8.93338 numMergedOcc 0
