0 mol 64 unq 0 iso 0 dist 6.48746 9.5663 7.89444 12.0987 9.82294 5.66803 5.40109 6.23138 9.23947 8.95689 numMergedOcc 0
1 mol 73 unq 0 iso 0 dist 9.75708 9.23755 6.17006 10.3397 12.7722 7.58027 15.0981 10.163 6.82707 12.5165 numMergedOcc 0
2 mol 73 unq 1 iso 0 dist 9.75708 9.23755 6.17006 8.31117 9.0383 4.34694 15.0981 10.163 6.82707 10.5011 numMergedOcc 0
3 mol 83 unq 0 iso 0 dist 9.31349 9.48319 15.0353 6.77806 14.386 7.72515 10.3314 13.2115 7.65069 7.26402 numMergedOcc 0
4 mol 83 unq 1 iso 0 dist 7.61666 9.48319 11.9566 6.77806 12.9318 7.72515 10.3314 12.1412 7.65069 7.26402 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 8.26954 7.40582 9.5797 15.2733 15.614 8.15664 16.1172 14.5374 8.96747 4.92054 numMergedOcc 0
6 mol 105 unq 0 iso 0 dist 9.46876 6.88033 5.95661 4.81647 13.0712 8.51572 11.7437 15.1659 9.23757 8.72987 numMergedOcc 0
7 mol 133 unq 0 iso 0 dist 8.78 5.19029 7.01552 5.92304 13.1705 7.57031 5.16948 9.94824 8.36723 6.65679 numMergedOcc 0
8 mol 204 unq 0 iso 0 dist 9.19343 6.58174 7.51586 10.9794 11.5711 6.20044 11.4894 12.8797 9.23676 4.92804 numMergedOcc 0
9 mol 204 unq 1 iso 0 dist 9.19343 6.58174 7.51586 9.00243 13.9015 8.41232 11.4894 12.8797 9.23676 5.04697 numMergedOcc 0
10 mol 220 unq 0 iso 0 dist 6.62404 5.60195 4.68697 5.84371 12.1871 9.89039 7.03806 7.4513 7.46122 9.36068 numMergedOcc 0
11 mol 220 unq 1 iso 0 dist 6.62404 5.60195 4.68697 12.9073 12.0906 8.57174 7.03806 7.4513 7.46122 15.6078 numMergedOcc 0
12 mol 220 unq 2 iso 0 dist 9.37847 7.87359 4.68697 4.72275 12.1871 9.89039 4.69654 7.4513 7.46122 9.36068 numMergedOcc 0
13 mol 220 unq 3 iso 0 dist 9.37847 7.87359 4.68697 15.2936 12.0906 8.57174 4.69654 7.4513 7.46122 15.6078 numMergedOcc 0
14 mol 226 unq 0 iso 0 dist 9.31677 6.3687 9.96567 4.52889 9.03261 8.74399 6.62409 12.7784 5.3747 7.20864 numMergedOcc 0
15 mol 261 unq 0 iso 0 dist 8.07113 9.66298 13.4973 6.94755 12.4826 4.85199 11.7392 14.9602 6.45102 5.52134 numMergedOcc 0
16 mol 261 unq 1 iso 0 dist 8.07113 9.66298 13.4973 17.3605 21.6189 9.72159 11.7392 14.9602 6.45102 7.0673 numMergedOcc 0
17 mol 285 unq 0 iso 0 dist 5.77107 4.49395 6.37482 9.47966 13.5396 7.872 9.67478 8.65334 6.46935 9.75573 numMergedOcc 0
18 mol 285 unq 1 iso 0 dist 5.77107 4.49395 6.37482 6.49869 7.38536 6.32984 9.67478 8.65334 6.46935 5.78887 numMergedOcc 0
