0 mol 26 unq 0 iso 0 dist 9.90242 5.97065 5.88467 8.8533 7.29236 4.80984 8.69142 10.1664 4.98603 5.30297 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 9.07029 5.97065 6.66387 8.8533 6.29311 4.80984 8.69142 10.5687 4.98603 5.30297 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 9.12062 5.73257 10.7494 8.8717 14.7325 8.15141 7.66913 10.8394 4.41248 12.5406 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 6.35249 6.21143 5.27577 6.22124 9.90457 5.99852 9.46449 9.2388 9.84993 13.1663 numMergedOcc 0
4 mol 70 unq 0 iso 0 dist 9.2794 8.06918 11.9871 4.67358 10.1805 11.6542 6.13606 4.12515 9.29381 8.68801 numMergedOcc 0
5 mol 70 unq 1 iso 0 dist 9.2794 7.52623 9.5704 4.67358 10.1805 11.7156 6.13606 4.12515 6.40963 8.68801 numMergedOcc 0
6 mol 70 unq 2 iso 0 dist 9.2794 5.62294 10.9277 4.67358 10.1805 4.95817 6.13606 4.12515 8.69313 8.68801 numMergedOcc 0
7 mol 92 unq 0 iso 0 dist 7.32868 9.62702 4.47011 7.05954 6.3035 6.39495 6.15011 11.8069 13.5159 8.0763 numMergedOcc 0
8 mol 92 unq 1 iso 0 dist 7.32868 6.97484 11.9916 7.05954 6.3035 8.23539 6.15011 11.8069 6.50817 8.0763 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 6.26722 4.95674 4.49984 8.37793 9.32138 7.68389 9.29665 5.21047 6.61001 13.6359 numMergedOcc 0
10 mol 154 unq 0 iso 0 dist 9.71025 5.81632 6.28784 6.03116 11.9291 8.33921 8.85675 10.3128 4.70993 10.4731 numMergedOcc 0
11 mol 195 unq 0 iso 0 dist 8.51112 8.64561 5.86183 8.22643 6.90444 5.15519 5.0778 4.58275 4.65391 6.74112 numMergedOcc 0
12 mol 209 unq 0 iso 0 dist 6.3344 5.20111 4.45815 9.95951 5.48319 9.89528 9.17634 7.34675 4.68679 12.4196 numMergedOcc 0
13 mol 209 unq 1 iso 0 dist 6.3344 5.20111 4.45815 6.43914 6.10304 9.02883 9.17634 7.34675 4.68679 12.5858 numMergedOcc 0
14 mol 226 unq 0 iso 0 dist 6.67272 9.51038 4.91346 6.06276 6.53326 11.3192 9.37981 5.94294 5.70052 10.1826 numMergedOcc 0
15 mol 226 unq 1 iso 0 dist 9.45332 9.51038 11.4807 6.06276 4.92768 11.3192 9.37981 11.9903 5.70052 10.1826 numMergedOcc 0
