0 mol 7 unq 0 iso 0 dist 8.33249 5.47645 5.77374 8.96896 8.0166 9.33944 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.34604 5.47645 8.57437 10.0019 9.67498 10.0257 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.34604 5.47645 8.57437 8.96896 9.32945 9.33944 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.43675 13.394 8.57437 8.40182 9.67498 10.0257 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 7.43675 13.394 8.57437 15.7603 9.32945 9.33944 numMergedOcc 0
5 mol 61 unq 0 iso 0 dist 8.88571 5.15272 9.82315 10.925 4.628 9.53688 numMergedOcc 0
6 mol 61 unq 1 iso 0 dist 8.92623 12.7474 9.67403 8.22304 8.30431 8.24748 numMergedOcc 0
7 mol 61 unq 2 iso 0 dist 8.92623 10.4703 7.28917 8.22304 8.30431 14.4616 numMergedOcc 0
8 mol 76 unq 0 iso 0 dist 7.76963 6.03473 9.06225 4.07128 7.02854 8.04327 numMergedOcc 0
9 mol 103 unq 0 iso 0 dist 7.5724 3.19331 8.9889 9.81867 7.57822 10.1806 numMergedOcc 0
10 mol 103 unq 1 iso 0 dist 7.5724 8.65165 6.67575 9.81867 7.57822 4.36597 numMergedOcc 0
11 mol 148 unq 0 iso 0 dist 6.89518 11.8881 9.22427 10.7947 9.71692 14.778 numMergedOcc 0
12 mol 150 unq 0 iso 0 dist 6.84108 11.8345 9.32504 10.8301 9.73708 14.922 numMergedOcc 0
13 mol 183 unq 0 iso 0 dist 9.84306 9.24396 9.92635 9.81052 6.21267 13.34 numMergedOcc 0
14 mol 183 unq 1 iso 0 dist 9.84306 9.24396 9.92635 15.1597 7.41743 13.9426 numMergedOcc 0
15 mol 183 unq 2 iso 0 dist 9.84306 6.29417 7.85507 9.81052 6.21267 9.98606 numMergedOcc 0
16 mol 183 unq 3 iso 0 dist 9.84306 6.29417 7.85507 15.1597 7.41743 11.9935 numMergedOcc 0
17 mol 197 unq 0 iso 0 dist 8.67145 8.64161 5.79753 10.5351 8.51118 12.1167 numMergedOcc 0
18 mol 197 unq 1 iso 0 dist 8.67145 5.68443 7.56537 10.5351 8.51118 5.79567 numMergedOcc 0
19 mol 205 unq 0 iso 0 dist 6.69726 5.94481 8.56656 7.00296 9.68829 12.3775 numMergedOcc 0
20 mol 205 unq 1 iso 0 dist 6.69726 5.94481 8.56656 5.06642 7.75205 4.13623 numMergedOcc 0
21 mol 211 unq 0 iso 0 dist 7.79873 6.83095 7.38723 16.6888 9.8921 12.6613 numMergedOcc 0
22 mol 226 unq 0 iso 0 dist 7.28604 12.9282 8.10096 11.6438 7.20862 6.92911 numMergedOcc 0
23 mol 265 unq 0 iso 0 dist 8.73109 5.20326 8.22353 5.41518 9.56472 8.39994 numMergedOcc 0
24 mol 265 unq 1 iso 0 dist 8.73109 5.20326 8.22353 7.57006 9.50814 5.62902 numMergedOcc 0
25 mol 266 unq 0 iso 0 dist 8.10271 10.604 9.33447 9.74722 5.28417 7.61055 numMergedOcc 0
26 mol 266 unq 1 iso 0 dist 8.10271 5.75486 3.90274 9.74722 5.28417 5.01049 numMergedOcc 0
27 mol 280 unq 0 iso 0 dist 9.27318 11.8962 7.10723 11.4108 7.02503 9.13465 numMergedOcc 0
28 mol 280 unq 1 iso 0 dist 9.27318 11.8962 7.10723 10.3813 9.18164 14.2183 numMergedOcc 0
29 mol 280 unq 2 iso 0 dist 9.27318 3.86473 6.8664 11.4108 7.02503 7.59724 numMergedOcc 0
30 mol 280 unq 3 iso 0 dist 9.27318 3.86473 6.8664 10.3813 9.18164 7.88431 numMergedOcc 0
