0 mol 26 unq 0 iso 0 dist 8.98417 12.1122 9.5053 15.148 6.81961 9.97991 numMergedOcc 0
1 mol 85 unq 0 iso 0 dist 9.18097 11.155 8.70863 16.376 10.2703 8.09408 numMergedOcc 0
2 mol 85 unq 1 iso 0 dist 8.83135 15.3247 8.70863 11.3406 10.2703 8.09408 numMergedOcc 0
3 mol 114 unq 0 iso 0 dist 4.86767 8.16908 9.35942 11.6281 14.3305 6.07991 numMergedOcc 0
4 mol 115 unq 0 iso 0 dist 8.12854 12.2787 8.85881 8.76598 5.67542 9.03491 numMergedOcc 0
5 mol 147 unq 0 iso 0 dist 8.40219 14.4753 7.25644 21.4463 14.6343 9.95533 numMergedOcc 0
6 mol 147 unq 1 iso 0 dist 8.40219 14.4753 7.25644 10.0885 5.93581 7.94147 numMergedOcc 0
7 mol 152 unq 0 iso 0 dist 8.49831 5.49264 5.06613 7.53667 5.8155 7.27943 numMergedOcc 0
8 mol 232 unq 0 iso 0 dist 8.27761 5.68442 6.57921 7.49905 5.53537 8.73422 numMergedOcc 0
9 mol 247 unq 0 iso 0 dist 6.29945 8.87922 9.84493 15.1949 18.3166 9.32591 numMergedOcc 0
10 mol 253 unq 0 iso 0 dist 9.29788 4.60689 8.15091 11.1436 8.89634 8.72947 numMergedOcc 0
11 mol 253 unq 1 iso 0 dist 9.50983 9.18036 8.15091 14.5589 8.89634 8.72947 numMergedOcc 0
12 mol 278 unq 0 iso 0 dist 9.73172 7.10699 7.21972 15.5152 7.41736 9.67619 numMergedOcc 0
