0 mol 43 unq 0 iso 0 dist 9.34433 6.84521 12.3867 7.84444 11.3924 8.01951 5.9674 7.32913 12.0317 12.2549 numMergedOcc 0
1 mol 43 unq 1 iso 0 dist 9.34433 8.90024 12.0037 7.84444 11.3924 12.2025 5.9674 7.32913 12.0919 12.2549 numMergedOcc 0
2 mol 43 unq 2 iso 0 dist 9.34433 6.78532 6.9067 7.84444 11.3924 7.68348 5.9674 7.32913 9.47348 12.2549 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 6.09042 8.27156 10.894 4.89196 6.03786 5.49555 11.2147 9.11512 18.5792 14.2974 numMergedOcc 0
4 mol 94 unq 0 iso 0 dist 6.63924 6.31237 6.0901 6.64613 6.8527 7.39788 4.48902 9.25496 10.0945 10.6555 numMergedOcc 0
5 mol 128 unq 0 iso 0 dist 8.20904 8.3127 11.1747 9.81998 9.60731 4.64539 12.8509 8.64054 14.3509 14.5532 numMergedOcc 0
6 mol 148 unq 0 iso 0 dist 6.4413 7.95671 5.34721 8.274 5.27089 5.29104 9.68187 9.18753 13.9381 10.8341 numMergedOcc 0
7 mol 150 unq 0 iso 0 dist 6.62609 8.12659 5.38822 8.39743 5.24014 5.45499 9.76535 9.15244 13.968 10.6874 numMergedOcc 0
8 mol 187 unq 0 iso 0 dist 9.55621 9.38169 4.98423 9.25105 8.43209 6.62321 9.61673 5.58167 6.82787 12.2628 numMergedOcc 0
9 mol 187 unq 1 iso 0 dist 9.55621 9.38169 4.98423 9.25105 8.43209 6.62321 12.9459 8.0501 12.7503 12.9656 numMergedOcc 0
10 mol 189 unq 0 iso 0 dist 8.01521 8.59972 6.36139 5.79707 8.33972 5.59904 9.29575 6.38294 11.5748 10.5796 numMergedOcc 0
11 mol 209 unq 0 iso 0 dist 9.20752 5.92907 9.95971 5.20111 5.80388 6.43758 9.95813 9.07668 11.1427 11.2703 numMergedOcc 0
12 mol 273 unq 0 iso 0 dist 7.29081 9.79022 11.0966 9.93542 10.5519 7.00883 12.2394 5.78262 16.2765 14.1435 numMergedOcc 0
13 mol 273 unq 1 iso 0 dist 7.29081 9.79022 11.0966 9.93542 10.5519 7.00883 7.5139 7.6489 15.7926 13.0974 numMergedOcc 0
