0 mol 6 unq 0 iso 0 dist 8.26077 7.9786 13.3695 12.3325 8.36949 19.7571 numMergedOcc 0
1 mol 6 unq 1 iso 0 dist 8.26077 7.9786 13.3695 8.72826 8.8273 16.4238 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 6.00504 7.82362 11.4038 5.86904 6.61704 12.5474 numMergedOcc 0
3 mol 61 unq 0 iso 0 dist 6.56878 6.56395 8.0979 14.0291 9.94756 17.9242 numMergedOcc 0
4 mol 61 unq 1 iso 0 dist 6.56395 6.56878 8.0979 9.03724 6.85094 12.8266 numMergedOcc 0
5 mol 69 unq 0 iso 0 dist 8.69782 7.69888 3.83043 12.7376 8.51894 8.27592 numMergedOcc 0
6 mol 69 unq 1 iso 0 dist 7.69888 8.69782 3.83043 12.7376 8.27592 8.51894 numMergedOcc 0
7 mol 69 unq 2 iso 0 dist 9.35592 9.6155 3.83043 5.09333 8.51894 8.27592 numMergedOcc 0
8 mol 69 unq 3 iso 0 dist 9.6155 9.35592 3.83043 5.09333 8.27592 8.51894 numMergedOcc 0
9 mol 73 unq 0 iso 0 dist 8.27446 9.76332 4.4628 10.116 8.40844 6.99156 numMergedOcc 0
10 mol 73 unq 1 iso 0 dist 8.27446 9.76332 4.4628 8.54022 7.02351 10.4593 numMergedOcc 0
11 mol 73 unq 2 iso 0 dist 8.27446 9.76332 4.4628 15.6804 8.66342 7.21285 numMergedOcc 0
12 mol 73 unq 3 iso 0 dist 9.76332 8.27446 4.4628 10.116 6.99156 8.40844 numMergedOcc 0
13 mol 73 unq 4 iso 0 dist 9.76332 8.27446 4.4628 15.6804 7.21285 8.66342 numMergedOcc 0
14 mol 102 unq 0 iso 0 dist 8.63253 5.15752 7.56811 5.89461 9.61113 7.59973 numMergedOcc 0
15 mol 102 unq 1 iso 0 dist 8.63253 5.15752 7.56811 8.38008 7.73836 10.8539 numMergedOcc 0
16 mol 102 unq 2 iso 0 dist 5.15752 8.63253 7.56811 5.89461 7.59973 9.61113 numMergedOcc 0
17 mol 115 unq 0 iso 0 dist 8.0631 9.63311 10.9911 9.13942 8.16113 16.9238 numMergedOcc 0
18 mol 115 unq 1 iso 0 dist 8.0631 8.90273 5.77823 9.13942 8.16113 9.69719 numMergedOcc 0
19 mol 249 unq 0 iso 0 dist 8.05967 9.62613 5.2966 4.38116 5.66519 6.50067 numMergedOcc 0
20 mol 249 unq 1 iso 0 dist 9.62613 8.05967 5.2966 4.38116 6.50067 5.66519 numMergedOcc 0
21 mol 249 unq 2 iso 0 dist 8.75137 7.82699 5.2966 8.24395 5.66519 6.50067 numMergedOcc 0
22 mol 249 unq 3 iso 0 dist 7.82699 8.75137 5.2966 8.24395 6.50067 5.66519 numMergedOcc 0
23 mol 260 unq 0 iso 0 dist 8.78344 4.1077 5.54154 7.3067 8.66784 8.3298 numMergedOcc 0
24 mol 260 unq 1 iso 0 dist 4.1077 8.78344 5.54154 5.14726 9.05149 13.9209 numMergedOcc 0
25 mol 260 unq 2 iso 0 dist 4.1077 8.78344 5.54154 7.3067 8.3298 8.66784 numMergedOcc 0
26 mol 265 unq 0 iso 0 dist 8.25956 9.51551 7.82127 6.60526 5.10595 11.5573 numMergedOcc 0
27 mol 266 unq 0 iso 0 dist 5.59326 9.66652 6.19097 6.09216 9.27042 9.88818 numMergedOcc 0
28 mol 266 unq 1 iso 0 dist 9.66652 5.59326 6.19097 6.09216 9.88818 9.27042 numMergedOcc 0
29 mol 277 unq 0 iso 0 dist 7.64708 5.73065 11.4925 5.57184 8.83777 9.42812 numMergedOcc 0
30 mol 277 unq 1 iso 0 dist 5.73065 7.64708 11.4925 5.57184 9.42812 8.83777 numMergedOcc 0
