0 mol 63 unq 0 iso 0 dist 8.20976 13.2028 9.93484 12.0713 6.29544 7.44913 numMergedOcc 0
1 mol 91 unq 0 iso 0 dist 8.6176 6.16048 6.29207 9.63646 9.40413 8.91354 numMergedOcc 0
2 mol 127 unq 0 iso 0 dist 9.91321 5.88232 7.34368 10.7696 4.49551 5.83719 numMergedOcc 0
3 mol 132 unq 0 iso 0 dist 8.31873 7.68244 9.11314 10.6 10.2787 6.94745 numMergedOcc 0
4 mol 152 unq 0 iso 0 dist 9.94212 7.14779 6.83034 9.66811 6.41178 9.65031 numMergedOcc 0
5 mol 158 unq 0 iso 0 dist 9.18848 11.2678 7.41387 8.80952 4.1393 9.96635 numMergedOcc 0
6 mol 162 unq 0 iso 0 dist 8.99034 5.55488 6.66396 9.74749 4.15457 7.30751 numMergedOcc 0
7 mol 174 unq 0 iso 0 dist 8.99695 7.31124 4.97597 14.2103 9.24028 7.27146 numMergedOcc 0
8 mol 174 unq 1 iso 0 dist 8.99695 7.31124 4.97597 12.1911 8.00637 6.25798 numMergedOcc 0
9 mol 175 unq 0 iso 0 dist 9.52193 6.623 9.11753 8.57666 4.71126 7.30813 numMergedOcc 0
10 mol 198 unq 0 iso 0 dist 9.7384 10.9859 8.95625 12.6365 4.13224 7.86075 numMergedOcc 0
11 mol 198 unq 1 iso 0 dist 8.89259 8.22776 8.95625 11.3252 4.13224 7.86075 numMergedOcc 0
12 mol 198 unq 2 iso 0 dist 9.95733 16.8636 8.95625 13.9358 4.13224 7.86075 numMergedOcc 0
13 mol 198 unq 3 iso 0 dist 9.72176 14.2746 8.95625 13.553 4.13224 7.86075 numMergedOcc 0
14 mol 206 unq 0 iso 0 dist 6.38964 5.59897 5.99766 13.4306 9.82099 9.42047 numMergedOcc 0
15 mol 230 unq 0 iso 0 dist 8.74988 6.28086 7.5725 5.19913 6.72933 9.24729 numMergedOcc 0
16 mol 243 unq 0 iso 0 dist 7.39089 14.2074 7.43688 9.58608 3.74434 8.78924 numMergedOcc 0
17 mol 243 unq 1 iso 0 dist 7.39089 14.2074 7.43688 11.4335 4.14613 4.64178 numMergedOcc 0
18 mol 243 unq 2 iso 0 dist 7.39089 5.80426 5.50716 9.58608 3.74434 7.70472 numMergedOcc 0
19 mol 243 unq 3 iso 0 dist 7.39089 5.80426 5.50716 11.4335 4.14613 9.16988 numMergedOcc 0
20 mol 265 unq 0 iso 0 dist 6.21022 4.47698 7.29987 9.94957 6.85532 7.52632 numMergedOcc 0
21 mol 265 unq 1 iso 0 dist 8.06252 5.62902 7.29987 8.01664 6.85532 7.52632 numMergedOcc 0
22 mol 266 unq 0 iso 0 dist 7.01175 8.61267 9.27812 10.2383 4.07542 9.0836 numMergedOcc 0
23 mol 266 unq 1 iso 0 dist 7.01175 8.61267 9.27812 13.0359 8.72214 9.62494 numMergedOcc 0
24 mol 266 unq 2 iso 0 dist 7.50074 14.1041 9.27812 11.2674 4.07542 9.0836 numMergedOcc 0
25 mol 266 unq 3 iso 0 dist 7.50074 14.1041 9.27812 14.7514 8.72214 9.62494 numMergedOcc 0
26 mol 286 unq 0 iso 0 dist 8.77242 11.156 9.09717 13.3562 8.40229 6.83763 numMergedOcc 0
