0 mol 2 unq 0 iso 0 dist 7.99162 9.3761 8.44439 6.38677 9.58976 9.39313 numMergedOcc 0
1 mol 2 unq 1 iso 0 dist 7.99162 9.3761 8.44439 5.59831 6.35342 11.4462 numMergedOcc 0
2 mol 26 unq 0 iso 0 dist 8.54885 7.37634 14.5663 6.89195 8.94292 11.0176 numMergedOcc 0
3 mol 26 unq 1 iso 0 dist 8.54885 7.37634 14.5663 7.78176 7.14934 14.563 numMergedOcc 0
4 mol 43 unq 0 iso 0 dist 8.06275 9.72346 9.86609 5.71662 9.74445 10.7958 numMergedOcc 0
5 mol 43 unq 1 iso 0 dist 6.35333 9.2958 3.84053 5.97717 9.18371 12.9825 numMergedOcc 0
6 mol 54 unq 0 iso 0 dist 6.72872 6.6367 6.91496 10.3388 5.38191 10.614 numMergedOcc 0
7 mol 69 unq 0 iso 0 dist 6.92837 5.38363 10.8149 5.74577 9.57969 8.93237 numMergedOcc 0
8 mol 78 unq 0 iso 0 dist 5.8992 9.9934 6.67525 5.18488 6.7763 7.22914 numMergedOcc 0
9 mol 92 unq 0 iso 0 dist 9.96446 4.96173 11.3522 14.2688 7.86724 15.6549 numMergedOcc 0
10 mol 92 unq 1 iso 0 dist 8.3558 7.06722 9.85978 5.38868 4.98104 7.80279 numMergedOcc 0
11 mol 102 unq 0 iso 0 dist 8.84131 9.00369 3.48119 10.8385 9.10229 5.88034 numMergedOcc 0
12 mol 111 unq 0 iso 0 dist 6.34542 9.83758 6.34994 11.5209 8.42147 11.3324 numMergedOcc 0
13 mol 115 unq 0 iso 0 dist 8.43116 9.82655 12.6623 7.46653 6.7225 15.2521 numMergedOcc 0
14 mol 142 unq 0 iso 0 dist 4.93681 6.4119 4.05822 5.20379 7.57458 5.79144 numMergedOcc 0
15 mol 155 unq 0 iso 0 dist 8.00286 9.13875 4.82 5.88616 7.02715 7.24503 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 9.52413 8.86574 4.04122 4.62432 7.66381 7.005 numMergedOcc 0
17 mol 205 unq 0 iso 0 dist 6.11505 4.72209 7.35363 5.03046 8.43584 5.32465 numMergedOcc 0
18 mol 235 unq 0 iso 0 dist 5.60236 5.49475 4.67058 7.33514 9.71281 11.7597 numMergedOcc 0
19 mol 235 unq 1 iso 0 dist 9.03917 7.8548 4.67058 10.7399 9.71281 11.7597 numMergedOcc 0
20 mol 239 unq 0 iso 0 dist 8.82778 9.0495 4.61469 12.7518 6.37342 10.9363 numMergedOcc 0
21 mol 241 unq 0 iso 0 dist 6.90245 7.65636 4.07839 10.121 9.72526 12.8183 numMergedOcc 0
22 mol 248 unq 0 iso 0 dist 7.40475 5.76741 6.19721 11.0674 8.71859 11.3246 numMergedOcc 0
23 mol 264 unq 0 iso 0 dist 9.07206 6.26593 13.3122 5.7123 6.28512 10.9315 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 9.38793 7.05489 9.94225 12.7183 6.60309 15.7986 numMergedOcc 0
25 mol 285 unq 0 iso 0 dist 6.44657 5.93983 8.33646 14.1417 8.71213 17.0071 numMergedOcc 0
