0 mol 34 unq 0 iso 0 dist 6.88388 8.74894 6.93364 5.85441 8.63361 11.952 numMergedOcc 0
1 mol 34 unq 1 iso 0 dist 6.88388 6.0282 6.34821 5.85441 8.63361 11.0362 numMergedOcc 0
2 mol 56 unq 0 iso 0 dist 8.70353 16.6168 8.98797 13.4548 6.91393 5.73443 numMergedOcc 0
3 mol 56 unq 1 iso 0 dist 8.70353 16.6168 8.98797 14.062 8.40038 11.075 numMergedOcc 0
4 mol 90 unq 0 iso 0 dist 4.35437 7.88117 7.54496 4.04916 7.51138 10.2107 numMergedOcc 0
5 mol 90 unq 1 iso 0 dist 4.35437 7.88117 7.54496 9.70636 9.86843 10.6903 numMergedOcc 0
6 mol 90 unq 2 iso 0 dist 4.35437 7.88117 7.54496 8.46448 6.86146 10.968 numMergedOcc 0
7 mol 90 unq 3 iso 0 dist 4.35437 7.88117 7.54496 10.7717 8.83296 5.69605 numMergedOcc 0
8 mol 154 unq 0 iso 0 dist 6.89591 14.1742 9.47362 13.5223 9.71408 5.63464 numMergedOcc 0
9 mol 154 unq 1 iso 0 dist 6.89591 5.33656 6.28417 13.5223 9.71408 13.5582 numMergedOcc 0
10 mol 156 unq 0 iso 0 dist 6.23534 6.02842 8.49473 8.74124 5.90883 13.3907 numMergedOcc 0
11 mol 156 unq 1 iso 0 dist 6.23534 4.61964 6.87906 8.74124 5.90883 10.5496 numMergedOcc 0
12 mol 156 unq 2 iso 0 dist 6.23534 11.3518 7.94975 8.74124 5.90883 9.19336 numMergedOcc 0
13 mol 156 unq 3 iso 0 dist 6.23534 9.94511 9.39865 8.74124 5.90883 4.24398 numMergedOcc 0
14 mol 193 unq 0 iso 0 dist 9.07517 6.21288 8.76185 10.9189 5.44396 11.5632 numMergedOcc 0
15 mol 193 unq 1 iso 0 dist 9.07517 6.21288 8.76185 7.05903 6.22972 5.08201 numMergedOcc 0
16 mol 194 unq 0 iso 0 dist 8.26119 17.2935 9.77862 9.55026 5.52678 12.0339 numMergedOcc 0
17 mol 194 unq 1 iso 0 dist 8.26119 17.2935 9.77862 5.81844 9.81666 18.7006 numMergedOcc 0
18 mol 194 unq 2 iso 0 dist 9.10338 7.32655 9.77862 7.42146 5.52678 12.0339 numMergedOcc 0
19 mol 194 unq 3 iso 0 dist 9.10338 7.32655 9.77862 14.7061 9.81666 18.7006 numMergedOcc 0
20 mol 218 unq 0 iso 0 dist 8.1139 9.04724 6.23898 4.36657 8.22792 6.08698 numMergedOcc 0
21 mol 225 unq 0 iso 0 dist 7.81918 6.299 5.13453 12.4669 6.53728 8.99405 numMergedOcc 0
22 mol 225 unq 1 iso 0 dist 8.92533 6.98496 5.13453 14.9481 6.53728 8.99405 numMergedOcc 0
23 mol 225 unq 2 iso 0 dist 7.55355 8.12068 7.29542 11.802 6.53728 7.13893 numMergedOcc 0
24 mol 250 unq 0 iso 0 dist 5.01762 8.43014 8.70484 12.0912 9.60364 6.11942 numMergedOcc 0
25 mol 264 unq 0 iso 0 dist 9.84667 4.52597 9.42738 11.6262 5.74568 8.79843 numMergedOcc 0
26 mol 294 unq 0 iso 0 dist 9.66445 14.8622 8.32473 6.89875 7.41079 8.73481 numMergedOcc 0
