0 mol 7 unq 0 iso 0 dist 5.80034 14.8431 9.85726 9.49401 5.25379 6.7985 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 5.80034 14.8431 9.85726 10.5539 5.03532 6.44736 numMergedOcc 0
2 mol 11 unq 0 iso 0 dist 6.27964 4.37231 6.79478 6.29106 5.15125 4.30695 numMergedOcc 0
3 mol 11 unq 1 iso 0 dist 6.27964 4.37231 6.79478 7.05626 10.9655 6.35398 numMergedOcc 0
4 mol 11 unq 2 iso 0 dist 5.8689 4.80143 6.79478 6.49542 5.15125 4.30695 numMergedOcc 0
5 mol 11 unq 3 iso 0 dist 5.8689 4.80143 6.79478 11.1189 10.9655 6.35398 numMergedOcc 0
6 mol 58 unq 0 iso 0 dist 7.93406 7.71984 7.84983 8.80308 6.64072 5.93884 numMergedOcc 0
7 mol 58 unq 1 iso 0 dist 7.93406 4.67517 9.56737 8.80308 6.64072 7.68678 numMergedOcc 0
8 mol 98 unq 0 iso 0 dist 7.28942 15.3149 9.59261 10.4106 5.24592 5.78706 numMergedOcc 0
9 mol 98 unq 1 iso 0 dist 7.28942 6.69791 6.67936 10.4106 5.24592 5.59328 numMergedOcc 0
10 mol 98 unq 2 iso 0 dist 7.28942 10.9221 8.25817 10.4106 5.24592 7.5242 numMergedOcc 0
11 mol 108 unq 0 iso 0 dist 6.29966 10.051 7.29462 8.50992 4.70778 9.01852 numMergedOcc 0
12 mol 108 unq 1 iso 0 dist 6.29966 10.051 7.29462 16.0858 11.386 9.75958 numMergedOcc 0
13 mol 108 unq 2 iso 0 dist 9.31725 15.8859 7.29462 8.00008 4.70778 9.01852 numMergedOcc 0
14 mol 108 unq 3 iso 0 dist 9.31725 15.8859 7.29462 16.5763 11.386 9.75958 numMergedOcc 0
15 mol 108 unq 4 iso 0 dist 9.57358 14.7085 7.29462 7.79698 4.70778 9.01852 numMergedOcc 0
16 mol 108 unq 5 iso 0 dist 9.57358 14.7085 7.29462 16.1229 11.386 9.75958 numMergedOcc 0
17 mol 108 unq 6 iso 0 dist 5.38329 4.56297 7.29462 7.18748 4.70778 9.01852 numMergedOcc 0
18 mol 108 unq 7 iso 0 dist 5.38329 4.56297 7.29462 11.7241 11.386 9.75958 numMergedOcc 0
19 mol 108 unq 8 iso 0 dist 7.62421 4.56297 5.4057 7.18748 6.76634 9.01852 numMergedOcc 0
20 mol 108 unq 9 iso 0 dist 7.62421 4.56297 5.4057 11.7241 6.17742 9.75958 numMergedOcc 0
21 mol 196 unq 0 iso 0 dist 8.62618 8.07956 6.76923 14.4961 9.91514 6.86319 numMergedOcc 0
22 mol 198 unq 0 iso 0 dist 7.2078 10.5082 6.47339 11.8034 5.47473 6.34616 numMergedOcc 0
23 mol 205 unq 0 iso 0 dist 7.9678 9.7129 8.43584 10.6262 5.42117 4.8668 numMergedOcc 0
24 mol 210 unq 0 iso 0 dist 8.14413 5.06314 9.67457 11.3236 11.6718 7.10826 numMergedOcc 0
25 mol 236 unq 0 iso 0 dist 6.02845 5.6375 9.31246 7.87572 5.87054 7.1686 numMergedOcc 0
26 mol 238 unq 0 iso 0 dist 6.86905 5.88384 5.56719 6.62283 11.9863 9.24557 numMergedOcc 0
27 mol 239 unq 0 iso 0 dist 5.62744 9.00069 6.37342 10.5753 7.48655 8.84636 numMergedOcc 0
28 mol 248 unq 0 iso 0 dist 6.80314 6.00666 7.66519 10.2551 5.81577 7.16525 numMergedOcc 0
29 mol 249 unq 0 iso 0 dist 8.9281 12.6924 7.29898 12.7606 10.4369 5.48118 numMergedOcc 0
30 mol 273 unq 0 iso 0 dist 6.98729 4.89166 7.89852 10.8276 5.62662 9.18157 numMergedOcc 0
31 mol 282 unq 0 iso 0 dist 5.72197 4.36798 5.67266 11.3833 7.46507 9.0975 numMergedOcc 0
