0 mol 68 unq 0 iso 0 dist 6.88001 7.94809 3.89292 4.9983 11.023 10.6352 numMergedOcc 0
1 mol 69 unq 0 iso 0 dist 9.30739 9.40686 8.3712 5.38363 11.2122 14.1026 numMergedOcc 0
2 mol 70 unq 0 iso 0 dist 4.86511 9.29166 8.93982 9.87737 10.4666 15.5765 numMergedOcc 0
3 mol 70 unq 1 iso 0 dist 4.86511 9.29166 8.93982 6.7303 7.63128 11.9297 numMergedOcc 0
4 mol 73 unq 0 iso 0 dist 5.39344 6.35752 11.4357 5.98764 4.05022 10.9695 numMergedOcc 0
5 mol 73 unq 1 iso 0 dist 5.39344 8.88238 7.65084 5.98764 4.05022 11.0673 numMergedOcc 0
6 mol 113 unq 0 iso 0 dist 6.84563 9.86007 4.35547 8.78269 5.90637 3.6851 numMergedOcc 0
7 mol 169 unq 0 iso 0 dist 9.17931 6.58855 7.95373 7.07933 5.88521 8.64393 numMergedOcc 0
8 mol 174 unq 0 iso 0 dist 7.10912 8.14253 10.3888 7.43369 7.13704 5.51536 numMergedOcc 0
9 mol 174 unq 1 iso 0 dist 7.10912 8.14253 10.3888 6.85127 4.45323 6.38335 numMergedOcc 0
10 mol 195 unq 0 iso 0 dist 8.28543 8.77346 6.27914 9.33055 16.1839 13.0944 numMergedOcc 0
11 mol 197 unq 0 iso 0 dist 7.23999 9.80084 5.67439 8.35976 4.49149 3.3957 numMergedOcc 0
12 mol 197 unq 1 iso 0 dist 7.23999 7.34627 8.11583 8.35976 4.49149 11.4868 numMergedOcc 0
13 mol 197 unq 2 iso 0 dist 7.23999 8.05081 9.51208 8.35976 4.49149 13.3465 numMergedOcc 0
14 mol 197 unq 3 iso 0 dist 7.23999 5.38508 8.06263 8.35976 4.49149 11.2924 numMergedOcc 0
15 mol 197 unq 4 iso 0 dist 7.23999 6.51529 11.5963 8.35976 4.49149 14.0042 numMergedOcc 0
16 mol 206 unq 0 iso 0 dist 9.89665 6.28518 6.37736 7.54599 14.3269 10.7204 numMergedOcc 0
17 mol 225 unq 0 iso 0 dist 9.32657 9.7268 17.1762 8.81424 15.3903 3.10571 numMergedOcc 0
18 mol 225 unq 1 iso 0 dist 9.32657 9.7268 17.1762 9.60949 12.2323 16.4394 numMergedOcc 0
19 mol 235 unq 0 iso 0 dist 9.08448 7.79729 13.5465 7.8548 14.6217 5.70734 numMergedOcc 0
20 mol 254 unq 0 iso 0 dist 8.85328 8.10339 4.84762 7.57834 3.71879 7.5396 numMergedOcc 0
21 mol 254 unq 1 iso 0 dist 8.85328 8.59635 6.23877 7.57834 3.71879 5.90756 numMergedOcc 0
22 mol 254 unq 2 iso 0 dist 7.46584 8.81893 4.84762 8.9475 5.04917 9.85273 numMergedOcc 0
23 mol 254 unq 3 iso 0 dist 7.46584 8.81893 4.84762 8.26189 5.5598 10.1133 numMergedOcc 0
24 mol 254 unq 4 iso 0 dist 7.46584 8.81893 4.84762 5.75348 3.71879 7.5396 numMergedOcc 0
25 mol 270 unq 0 iso 0 dist 8.77116 8.19788 10.2271 8.93961 10.8246 4.41063 numMergedOcc 0
26 mol 270 unq 1 iso 0 dist 8.77116 8.19788 10.2271 7.96508 13.2466 15.6327 numMergedOcc 0
27 mol 270 unq 2 iso 0 dist 7.18907 8.19788 8.39454 8.93961 6.71164 4.41063 numMergedOcc 0
28 mol 270 unq 3 iso 0 dist 7.18907 8.19788 8.39454 7.96508 11.0423 15.6327 numMergedOcc 0
