0 mol 13 unq 0 iso 0 dist 5.4424 4.14738 8.05984 7.71544 9.24347 9.18487 numMergedOcc 0
1 mol 32 unq 0 iso 0 dist 9.03144 10.361 8.34024 13.2267 5.03226 7.88576 numMergedOcc 0
2 mol 52 unq 0 iso 0 dist 8.73526 4.75796 7.46764 12.628 7.31045 8.6668 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 8.69443 4.07863 5.45575 5.81747 13.5189 8.17564 numMergedOcc 0
4 mol 59 unq 1 iso 0 dist 8.69443 4.07863 5.45575 6.81975 12.1252 7.19213 numMergedOcc 0
5 mol 59 unq 2 iso 0 dist 8.69443 4.07863 5.45575 10.0694 5.30815 6.94351 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 9.98577 4.42702 7.1249 9.4022 14.3736 8.39101 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 9.98577 4.42702 7.1249 10.6928 8.79315 6.57826 numMergedOcc 0
8 mol 133 unq 0 iso 0 dist 5.68599 6.11049 8.49888 8.64946 5.80658 6.73897 numMergedOcc 0
9 mol 148 unq 0 iso 0 dist 9.53814 6.56193 9.66935 10.9593 9.67218 8.07915 numMergedOcc 0
10 mol 154 unq 0 iso 0 dist 7.31277 6.28784 8.583 10.6788 7.11787 8.46844 numMergedOcc 0
11 mol 159 unq 0 iso 0 dist 9.129 8.34466 9.66843 15.1787 12.3362 8.91189 numMergedOcc 0
12 mol 173 unq 0 iso 0 dist 7.93816 7.23914 9.25763 14.9558 18.7282 9.56248 numMergedOcc 0
13 mol 235 unq 0 iso 0 dist 8.88613 11.4951 7.29546 19.822 16.8959 9.74324 numMergedOcc 0
14 mol 273 unq 0 iso 0 dist 8.78928 13.7838 6.06557 21.2136 12.565 9.79283 numMergedOcc 0
15 mol 294 unq 0 iso 0 dist 6.42303 10.3713 7.82457 12.3722 8.04862 7.12793 numMergedOcc 0
16 mol 294 unq 1 iso 0 dist 6.42303 10.3713 7.82457 15.7257 11.4159 6.21208 numMergedOcc 0
