0 mol 4 unq 0 iso 0 dist 8.15534 7.1916 10.8543 5.10085 6.66589 10.4453 numMergedOcc 0
1 mol 4 unq 1 iso 0 dist 7.58769 7.1916 6.97334 5.10085 9.80478 10.4453 numMergedOcc 0
2 mol 21 unq 0 iso 0 dist 5.27589 8.10126 5.32052 9.07166 8.85347 12.7952 numMergedOcc 0
3 mol 38 unq 0 iso 0 dist 6.56791 9.71979 6.25326 5.45587 7.57586 12.6794 numMergedOcc 0
4 mol 85 unq 0 iso 0 dist 8.30129 7.17845 12.8076 10.76 9.29323 16.581 numMergedOcc 0
5 mol 102 unq 0 iso 0 dist 6.7095 9.2958 8.26254 5.26061 7.48277 13.1621 numMergedOcc 0
6 mol 102 unq 1 iso 0 dist 6.7095 9.2958 8.26254 8.90571 9.0361 14.9145 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 6.15949 5.37661 7.22809 6.49725 9.24515 11.8382 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 9.18707 9.17664 11.2217 4.82909 6.09472 11.7088 numMergedOcc 0
9 mol 115 unq 1 iso 0 dist 5.91786 9.17664 6.0336 4.82909 6.20658 11.7088 numMergedOcc 0
10 mol 115 unq 2 iso 0 dist 5.91786 9.17664 6.0336 6.68557 7.83568 6.55511 numMergedOcc 0
11 mol 250 unq 0 iso 0 dist 5.97672 9.6841 9.83854 6.15778 8.21206 12.473 numMergedOcc 0
12 mol 261 unq 0 iso 0 dist 6.93654 9.12695 13.2889 6.39263 8.50313 13.9801 numMergedOcc 0
13 mol 261 unq 1 iso 0 dist 9.66298 9.12695 16.7638 6.39263 7.6414 13.9801 numMergedOcc 0
14 mol 281 unq 0 iso 0 dist 6.81536 9.70995 15.779 7.23848 9.65665 11.8171 numMergedOcc 0
