0 mol 16 unq 0 iso 0 dist 9.46378 6.80052 5.31774 6.39388 6.0266 7.47858 numMergedOcc 0
1 mol 109 unq 0 iso 0 dist 8.35267 9.26438 11.8891 9.58922 9.10677 17.9663 numMergedOcc 0
2 mol 124 unq 0 iso 0 dist 8.25764 6.71293 5.31501 6.12676 8.18186 9.79969 numMergedOcc 0
3 mol 133 unq 0 iso 0 dist 8.34402 8.66715 6.80292 5.05981 5.80404 9.22232 numMergedOcc 0
4 mol 133 unq 1 iso 0 dist 8.34402 9.00172 11.8155 5.05981 5.80404 12.7901 numMergedOcc 0
5 mol 133 unq 2 iso 0 dist 8.07957 8.95433 6.80292 13.7968 5.80404 9.22232 numMergedOcc 0
6 mol 134 unq 0 iso 0 dist 6.42569 8.94541 9.54131 8.45048 7.80701 11.2937 numMergedOcc 0
7 mol 230 unq 0 iso 0 dist 8.2419 6.03738 5.45786 10.6874 8.78693 11.9641 numMergedOcc 0
8 mol 235 unq 0 iso 0 dist 6.82475 9.03917 11.9319 4.88651 6.86251 6.36341 numMergedOcc 0
9 mol 235 unq 1 iso 0 dist 6.82475 9.03917 11.9319 6.99274 6.20377 13.9626 numMergedOcc 0
10 mol 235 unq 2 iso 0 dist 6.82475 6.56775 5.19684 4.88651 6.86251 6.21292 numMergedOcc 0
11 mol 235 unq 3 iso 0 dist 6.82475 6.56775 5.19684 6.99274 6.20377 6.95126 numMergedOcc 0
12 mol 236 unq 0 iso 0 dist 9.86445 5.77925 10.054 7.23755 9.85348 10.4811 numMergedOcc 0
13 mol 266 unq 0 iso 0 dist 8.55696 6.95233 5.928 7.30886 9.85331 10.7037 numMergedOcc 0
14 mol 266 unq 1 iso 0 dist 8.55696 9.61741 9.08196 7.30886 9.85331 10.0654 numMergedOcc 0
15 mol 266 unq 2 iso 0 dist 8.55696 5.61056 6.4179 7.30886 9.85331 10.6338 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 5.73065 9.38793 12.4605 9.95264 5.92532 15.2518 numMergedOcc 0
