0 mol 15 unq 0 iso 0 dist 4.27439 7.57076 5.82801 4.20187 7.70482 11.7699 numMergedOcc 0
1 mol 17 unq 0 iso 0 dist 7.9118 8.35273 9.78953 4.79124 7.30541 7.18716 numMergedOcc 0
2 mol 62 unq 0 iso 0 dist 6.31934 8.1717 7.31044 10.8763 8.73923 13.2429 numMergedOcc 0
3 mol 88 unq 0 iso 0 dist 9.75856 9.57352 14.3183 8.05534 8.54948 15.404 numMergedOcc 0
4 mol 93 unq 0 iso 0 dist 7.65028 8.345 6.97911 4.54745 6.67776 10.5259 numMergedOcc 0
5 mol 93 unq 1 iso 0 dist 7.65028 6.06155 5.08254 4.54745 6.67776 8.2702 numMergedOcc 0
6 mol 123 unq 0 iso 0 dist 5.88484 8.7474 5.34596 10.7165 9.14514 14.4268 numMergedOcc 0
7 mol 123 unq 1 iso 0 dist 5.88484 8.7474 5.34596 5.55295 6.17633 11.2516 numMergedOcc 0
8 mol 123 unq 2 iso 0 dist 5.88484 9.54257 6.41552 10.7165 9.14514 12.0953 numMergedOcc 0
9 mol 123 unq 3 iso 0 dist 5.88484 9.54257 6.41552 5.55295 6.17633 10.3383 numMergedOcc 0
10 mol 130 unq 0 iso 0 dist 9.9205 9.48604 6.91242 5.92054 9.83243 7.50304 numMergedOcc 0
11 mol 220 unq 0 iso 0 dist 8.17723 7.39043 5.05766 4.61842 6.76533 6.23243 numMergedOcc 0
12 mol 266 unq 0 iso 0 dist 8.78501 7.51951 15.5294 4.00824 9.4961 9.2684 numMergedOcc 0
13 mol 266 unq 1 iso 0 dist 8.78501 7.51951 15.5294 6.68601 8.3978 11.1756 numMergedOcc 0
14 mol 266 unq 2 iso 0 dist 5.59641 7.51951 12.1427 4.00824 8.08479 9.2684 numMergedOcc 0
15 mol 281 unq 0 iso 0 dist 8.80931 7.82358 14.7035 10.9903 9.13318 18.769 numMergedOcc 0
16 mol 281 unq 1 iso 0 dist 6.97131 6.22003 3.78163 4.24956 9.09172 9.76665 numMergedOcc 0
17 mol 285 unq 0 iso 0 dist 4.9851 5.64165 5.42273 5.01654 7.85044 10.5532 numMergedOcc 0
