0 mol 10 unq 0 iso 0 dist 7.99404 8.95503 5.30796 3.5691 6.68744 6.50154 numMergedOcc 0
1 mol 44 unq 0 iso 0 dist 7.85573 9.4798 11.6488 6.03997 7.49423 14.6033 numMergedOcc 0
2 mol 88 unq 0 iso 0 dist 9.4046 6.98838 6.64721 3.48087 9.27633 6.1847 numMergedOcc 0
3 mol 88 unq 1 iso 0 dist 9.4046 6.98838 6.64721 10.8263 7.59715 10.5092 numMergedOcc 0
4 mol 92 unq 0 iso 0 dist 9.93688 7.57958 5.02124 13.7708 9.22123 10.4834 numMergedOcc 0
5 mol 92 unq 1 iso 0 dist 9.93688 7.57958 5.02124 14.5838 7.36335 7.03417 numMergedOcc 0
6 mol 100 unq 0 iso 0 dist 6.97361 7.90328 5.07584 7.0263 9.83944 13.4457 numMergedOcc 0
7 mol 147 unq 0 iso 0 dist 5.82034 9.8769 4.96701 10.5092 8.62135 11.7731 numMergedOcc 0
8 mol 155 unq 0 iso 0 dist 6.53806 9.89699 5.15684 6.57748 7.24503 10.9914 numMergedOcc 0
9 mol 155 unq 1 iso 0 dist 6.53806 9.16944 5.84938 6.57748 7.24503 10.2856 numMergedOcc 0
10 mol 181 unq 0 iso 0 dist 6.13872 8.45395 9.80135 3.55808 6.19329 11.7261 numMergedOcc 0
11 mol 181 unq 1 iso 0 dist 6.13872 5.41368 4.97806 3.55808 6.19329 7.61421 numMergedOcc 0
12 mol 183 unq 0 iso 0 dist 9.92635 7.42108 16.8061 5.27311 8.58178 11.8448 numMergedOcc 0
13 mol 183 unq 1 iso 0 dist 9.92635 7.42108 16.8061 6.58331 4.77438 13.2655 numMergedOcc 0
14 mol 183 unq 2 iso 0 dist 9.92635 7.42108 16.8061 12.5326 5.73344 18.7654 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 9.86348 8.72538 8.96075 5.18174 8.51947 10.6714 numMergedOcc 0
16 mol 197 unq 0 iso 0 dist 7.56537 9.62514 10.1284 8.82321 7.06868 9.77656 numMergedOcc 0
17 mol 234 unq 0 iso 0 dist 8.38742 7.19662 4.69096 9.98235 9.2653 7.35086 numMergedOcc 0
18 mol 259 unq 0 iso 0 dist 7.97113 8.46351 11.1732 9.58753 8.75224 9.61028 numMergedOcc 0
