0 mol 114 unq 0 iso 0 dist 8.79677 3.46142 9.68809 8.66766 10.9333 5.45716 numMergedOcc 0
1 mol 141 unq 0 iso 0 dist 9.73865 6.3489 5.07226 9.48934 10.3186 7.70581 numMergedOcc 0
2 mol 141 unq 1 iso 0 dist 8.52591 4.49133 5.07226 6.41183 10.3186 7.70581 numMergedOcc 0
3 mol 152 unq 0 iso 0 dist 9.66811 13.2207 9.17101 20.6371 15.2106 7.78215 numMergedOcc 0
4 mol 154 unq 0 iso 0 dist 8.65008 11.2153 9.2828 18.6816 18.053 9.82522 numMergedOcc 0
5 mol 154 unq 1 iso 0 dist 8.65008 11.2153 9.2828 19.4177 15.2697 8.50773 numMergedOcc 0
6 mol 159 unq 0 iso 0 dist 8.20121 7.38933 7.85744 12.5386 9.80598 9.46535 numMergedOcc 0
7 mol 169 unq 0 iso 0 dist 6.09291 9.58834 9.25597 7.50458 10.1931 9.39809 numMergedOcc 0
8 mol 169 unq 1 iso 0 dist 6.09291 9.58834 9.25597 5.79554 10.5136 8.38775 numMergedOcc 0
9 mol 169 unq 2 iso 0 dist 9.76796 4.25225 9.25597 13.1014 10.1931 9.39809 numMergedOcc 0
10 mol 169 unq 3 iso 0 dist 9.76796 4.25225 9.25597 12.3054 10.5136 8.38775 numMergedOcc 0
11 mol 169 unq 4 iso 0 dist 9.90583 5.61633 9.25597 11.8729 10.1931 9.39809 numMergedOcc 0
12 mol 169 unq 5 iso 0 dist 9.90583 5.61633 9.25597 12.9435 10.5136 8.38775 numMergedOcc 0
13 mol 222 unq 0 iso 0 dist 4.87053 6.37759 8.60727 4.90656 5.63584 8.47836 numMergedOcc 0
14 mol 266 unq 0 iso 0 dist 7.3055 16.1506 9.96942 16.6768 13.664 8.53393 numMergedOcc 0
15 mol 266 unq 1 iso 0 dist 7.3055 16.1506 9.96942 17.452 13.7979 7.24165 numMergedOcc 0
16 mol 268 unq 0 iso 0 dist 6.62669 4.29831 7.79813 6.18877 5.92765 8.00345 numMergedOcc 0
17 mol 268 unq 1 iso 0 dist 9.73984 4.29831 9.54291 6.18877 7.13665 8.00345 numMergedOcc 0
18 mol 283 unq 0 iso 0 dist 5.90728 3.27256 4.1631 9.35302 12.6455 9.74797 numMergedOcc 0
19 mol 283 unq 1 iso 0 dist 5.90728 3.27256 4.1631 8.85163 7.97597 9.90494 numMergedOcc 0
20 mol 287 unq 0 iso 0 dist 6.19545 13.3799 9.82863 17.9398 12.7664 8.70479 numMergedOcc 0
21 mol 288 unq 0 iso 0 dist 6.19545 13.3799 9.82863 17.9398 12.7664 8.70479 numMergedOcc 0
22 mol 289 unq 0 iso 0 dist 6.19545 13.3799 9.82863 17.9398 12.7664 8.70479 numMergedOcc 0
