0 mol 32 unq 0 iso 0 dist 6.32082 7.74348 7.6082 4.99112 6.76514 9.76176 numMergedOcc 0
1 mol 32 unq 1 iso 0 dist 6.32082 12.3417 9.24687 4.99112 6.76514 8.89775 numMergedOcc 0
2 mol 37 unq 0 iso 0 dist 6.85013 11.2319 9.77734 15.3094 9.64602 10.1799 numMergedOcc 0
3 mol 59 unq 0 iso 0 dist 6.9084 6.90675 5.68841 4.50806 7.37607 5.85924 numMergedOcc 0
4 mol 59 unq 1 iso 0 dist 6.9084 9.54437 7.75769 4.50806 7.37607 9.33131 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 7.36132 5.92597 9.91313 12.0694 8.68888 15.8729 numMergedOcc 0
6 mol 71 unq 0 iso 0 dist 6.82615 4.4972 9.75733 7.69536 6.88394 7.89273 numMergedOcc 0
7 mol 116 unq 0 iso 0 dist 9.93594 9.33983 8.51507 13.6462 9.88812 5.79458 numMergedOcc 0
8 mol 116 unq 1 iso 0 dist 9.93594 5.16799 8.22285 13.6462 9.88812 9.91115 numMergedOcc 0
9 mol 151 unq 0 iso 0 dist 8.7814 15.303 9.39452 13.7772 7.48309 5.32583 numMergedOcc 0
10 mol 154 unq 0 iso 0 dist 7.16289 4.81196 6.59749 10.9769 9.39643 6.28784 numMergedOcc 0
11 mol 154 unq 1 iso 0 dist 9.3164 7.0408 6.59749 5.33656 9.39643 6.28784 numMergedOcc 0
12 mol 220 unq 0 iso 0 dist 6.74945 7.21778 6.64341 4.75901 8.45955 8.39567 numMergedOcc 0
13 mol 220 unq 1 iso 0 dist 6.74945 7.21778 6.64341 9.80096 7.64168 8.58398 numMergedOcc 0
14 mol 220 unq 2 iso 0 dist 6.74945 4.35022 7.31315 4.75901 8.45955 6.65038 numMergedOcc 0
15 mol 220 unq 3 iso 0 dist 6.74945 4.35022 7.31315 9.80096 7.64168 9.86325 numMergedOcc 0
16 mol 220 unq 4 iso 0 dist 5.15585 9.58458 6.64341 6.61753 8.45955 8.39567 numMergedOcc 0
17 mol 220 unq 5 iso 0 dist 5.15585 9.58458 6.64341 5.13854 7.64168 8.58398 numMergedOcc 0
18 mol 220 unq 6 iso 0 dist 5.15585 9.67051 7.31315 6.61753 8.45955 6.65038 numMergedOcc 0
19 mol 220 unq 7 iso 0 dist 5.15585 9.67051 7.31315 5.13854 7.64168 9.86325 numMergedOcc 0
20 mol 279 unq 0 iso 0 dist 9.94974 16.1108 7.35799 14.961 8.46687 5.93805 numMergedOcc 0
21 mol 279 unq 1 iso 0 dist 4.54596 3.82462 7.35799 5.2006 8.46687 5.93805 numMergedOcc 0
22 mol 279 unq 2 iso 0 dist 8.32942 6.05145 7.35799 8.86683 8.46687 5.93805 numMergedOcc 0
