0 mol 0 unq 0 iso 0 dist 8.31596 7.92928 4.62412 4.22598 5.88757 6.94943 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 8.31596 7.48645 12.5081 4.22598 5.88757 10.8612 numMergedOcc 0
2 mol 0 unq 2 iso 0 dist 6.3267 7.92928 5.96303 4.22598 8.66548 6.94943 numMergedOcc 0
3 mol 0 unq 3 iso 0 dist 6.3267 7.48645 4.04089 4.22598 8.66548 10.8612 numMergedOcc 0
4 mol 9 unq 0 iso 0 dist 9.29529 8.04924 7.98363 3.91075 9.71516 7.05919 numMergedOcc 0
5 mol 9 unq 1 iso 0 dist 7.2199 8.04924 10.4204 3.91075 9.81658 7.05919 numMergedOcc 0
6 mol 9 unq 2 iso 0 dist 8.47109 7.25684 4.71922 14.6279 9.81658 13.8112 numMergedOcc 0
7 mol 45 unq 0 iso 0 dist 8.13782 7.95778 4.52443 4.51883 5.81001 7.72462 numMergedOcc 0
8 mol 114 unq 0 iso 0 dist 8.39249 8.11094 4.69847 4.81369 5.51885 7.59156 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 6.98849 7.59814 9.24851 3.95776 6.84165 10.5314 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 6.98849 9.7775 6.19569 3.95776 6.84165 10.2106 numMergedOcc 0
11 mol 134 unq 0 iso 0 dist 6.4218 8.77898 9.10548 11.3936 5.52149 12.3055 numMergedOcc 0
12 mol 173 unq 0 iso 0 dist 9.79554 7.79505 5.63016 12.9142 8.62366 10.7165 numMergedOcc 0
13 mol 173 unq 1 iso 0 dist 9.79554 7.79505 5.63016 12.5859 9.44973 13.0949 numMergedOcc 0
14 mol 173 unq 2 iso 0 dist 9.79554 7.79505 5.63016 14.5434 6.52508 11.7131 numMergedOcc 0
15 mol 225 unq 0 iso 0 dist 8.75834 5.13453 7.15437 11.3004 5.93063 11.472 numMergedOcc 0
16 mol 225 unq 1 iso 0 dist 8.75834 7.95883 15.2958 11.3004 5.93063 15.053 numMergedOcc 0
17 mol 225 unq 2 iso 0 dist 7.51827 7.29542 8.99405 13.317 8.91356 9.87668 numMergedOcc 0
18 mol 225 unq 3 iso 0 dist 7.51827 7.29542 8.99405 8.90754 9.57455 10.5222 numMergedOcc 0
19 mol 227 unq 0 iso 0 dist 6.152 7.89801 5.23507 5.99236 9.8009 13.0314 numMergedOcc 0
20 mol 227 unq 1 iso 0 dist 7.95168 7.89801 5.92529 12.0749 7.79951 5.28771 numMergedOcc 0
21 mol 234 unq 0 iso 0 dist 9.6101 9.06084 9.66782 13.9373 8.27411 14.5907 numMergedOcc 0
22 mol 234 unq 1 iso 0 dist 9.6101 9.06084 9.66782 10.72 6.96257 8.52295 numMergedOcc 0
23 mol 238 unq 0 iso 0 dist 6.65088 7.47235 5.8041 13.037 9.84652 12.1568 numMergedOcc 0
24 mol 238 unq 1 iso 0 dist 6.5772 7.61203 5.88491 9.75095 9.84652 6.53286 numMergedOcc 0
25 mol 238 unq 2 iso 0 dist 8.70193 6.92409 5.88491 11.7709 9.84652 6.53286 numMergedOcc 0
26 mol 238 unq 3 iso 0 dist 6.17025 6.89694 5.88491 6.12722 9.84652 6.53286 numMergedOcc 0
27 mol 238 unq 4 iso 0 dist 6.17025 6.44735 5.8041 6.12722 9.84652 12.1568 numMergedOcc 0
28 mol 238 unq 5 iso 0 dist 9.0378 5.91208 5.8041 12.1711 9.84652 12.1568 numMergedOcc 0
29 mol 243 unq 0 iso 0 dist 9.1101 6.01071 8.16841 10.106 9.33476 13.6245 numMergedOcc 0
30 mol 270 unq 0 iso 0 dist 6.79822 6.31869 5.30053 4.4142 9.04189 7.39185 numMergedOcc 0
31 mol 270 unq 1 iso 0 dist 9.17227 6.31869 8.58393 3.98629 9.51462 8.20158 numMergedOcc 0
32 mol 270 unq 2 iso 0 dist 9.17227 6.31869 8.58393 8.41656 8.12971 12.5701 numMergedOcc 0
33 mol 272 unq 0 iso 0 dist 6.75716 7.35433 6.3139 10.2399 8.84523 10.6235 numMergedOcc 0
34 mol 272 unq 1 iso 0 dist 6.75716 7.35433 6.3139 3.9539 6.95241 10.2298 numMergedOcc 0
