0 mol 19 unq 0 iso 0 dist 5.36258 6.44099 7.24362 6.57145 8.23643 7.97324 numMergedOcc 0
1 mol 21 unq 0 iso 0 dist 7.38586 6.62795 7.51251 5.62318 6.08338 7.81429 numMergedOcc 0
2 mol 21 unq 1 iso 0 dist 7.38586 7.67928 5.4965 5.62318 6.08338 9.39415 numMergedOcc 0
3 mol 75 unq 0 iso 0 dist 7.14313 9.18112 6.23298 6.77761 5.15851 7.16975 numMergedOcc 0
4 mol 88 unq 0 iso 0 dist 5.92974 7.85662 4.24369 6.06775 9.10189 9.30559 numMergedOcc 0
5 mol 88 unq 1 iso 0 dist 5.92974 7.85662 4.24369 13.4646 10.0292 5.96359 numMergedOcc 0
6 mol 88 unq 2 iso 0 dist 5.92974 7.85662 4.24369 12.7497 11.575 7.48974 numMergedOcc 0
7 mol 88 unq 3 iso 0 dist 5.92974 7.85662 4.24369 10.935 11.5156 8.40428 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 4.9835 8.04315 4.98036 11.5038 8.59981 5.72373 numMergedOcc 0
9 mol 127 unq 1 iso 0 dist 4.9835 8.04315 4.98036 12.1032 7.66331 7.20988 numMergedOcc 0
10 mol 133 unq 0 iso 0 dist 6.61636 9.79873 6.14787 12.4407 11.444 6.05583 numMergedOcc 0
11 mol 135 unq 0 iso 0 dist 8.6132 5.10333 5.42566 6.06401 11.53 6.67623 numMergedOcc 0
12 mol 152 unq 0 iso 0 dist 9.01078 9.17436 9.64763 5.85081 11.7455 5.85698 numMergedOcc 0
13 mol 157 unq 0 iso 0 dist 5.87379 5.81566 5.16713 5.46258 9.97573 7.02823 numMergedOcc 0
14 mol 157 unq 1 iso 0 dist 5.87379 5.81566 5.16713 13.6447 11.5477 8.97404 numMergedOcc 0
15 mol 239 unq 0 iso 0 dist 4.57548 5.52821 9.14905 8.70119 11.0695 7.21256 numMergedOcc 0
16 mol 239 unq 1 iso 0 dist 4.57548 5.52821 9.14905 10.1972 14.3009 7.71476 numMergedOcc 0
