0 mol 15 unq 0 iso 0 dist 5.19544 5.69927 5.89412 10.8364 7.49229 6.82187 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.27369 10.2609 6.46104 14.706 6.76331 6.12361 numMergedOcc 0
2 mol 68 unq 0 iso 0 dist 9.55838 9.96691 6.36086 10.0825 6.71259 9.27389 numMergedOcc 0
3 mol 91 unq 0 iso 0 dist 5.51406 10.2967 9.30539 11.385 11.1037 7.03536 numMergedOcc 0
4 mol 109 unq 0 iso 0 dist 8.48774 11.1132 6.60933 13.7482 6.25986 9.64641 numMergedOcc 0
5 mol 109 unq 1 iso 0 dist 9.53055 6.78736 6.60933 9.82647 6.25986 9.64641 numMergedOcc 0
6 mol 133 unq 0 iso 0 dist 6.16862 12.7925 9.22232 18.5863 15.0618 9.1146 numMergedOcc 0
7 mol 133 unq 1 iso 0 dist 9.70325 15.4258 9.22232 20.3751 15.0618 9.1146 numMergedOcc 0
8 mol 133 unq 2 iso 0 dist 9.04845 14.5617 6.16242 15.6721 11.4871 8.97762 numMergedOcc 0
9 mol 133 unq 3 iso 0 dist 7.94325 11.4104 6.16242 14.0276 11.4871 8.97762 numMergedOcc 0
10 mol 133 unq 4 iso 0 dist 6.72323 10.2385 6.16242 15.5644 11.4871 8.97762 numMergedOcc 0
11 mol 133 unq 5 iso 0 dist 6.42904 6.26797 9.22661 12.4361 9.68947 9.1146 numMergedOcc 0
12 mol 133 unq 6 iso 0 dist 7.31633 5.36939 7.56378 5.84909 5.10826 9.1146 numMergedOcc 0
13 mol 163 unq 0 iso 0 dist 9.62943 4.12904 9.07943 9.24754 3.7064 8.32426 numMergedOcc 0
14 mol 170 unq 0 iso 0 dist 9.53158 7.71028 6.35982 9.05865 4.11212 9.32245 numMergedOcc 0
15 mol 171 unq 0 iso 0 dist 6.21194 9.22906 9.61462 12.2975 8.94436 7.73971 numMergedOcc 0
16 mol 195 unq 0 iso 0 dist 8.80931 8.97729 9.26504 12.8447 8.71774 7.04524 numMergedOcc 0
17 mol 204 unq 0 iso 0 dist 8.62191 18.2283 9.68728 10.6489 4.29037 9.44947 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 5.86419 4.78067 4.8668 11.2971 10.0824 6.94789 numMergedOcc 0
19 mol 205 unq 1 iso 0 dist 5.86419 4.78067 4.8668 5.81277 5.00854 6.23932 numMergedOcc 0
20 mol 205 unq 2 iso 0 dist 7.23557 4.2475 4.8668 9.85777 10.0824 6.94789 numMergedOcc 0
21 mol 205 unq 3 iso 0 dist 7.23557 4.2475 4.8668 5.05912 5.00854 6.23932 numMergedOcc 0
22 mol 205 unq 4 iso 0 dist 8.86587 6.8901 4.8668 10.4571 10.0824 6.94789 numMergedOcc 0
23 mol 205 unq 5 iso 0 dist 8.86587 6.8901 4.8668 6.60429 5.00854 6.23932 numMergedOcc 0
24 mol 226 unq 0 iso 0 dist 7.04477 10.0275 8.80683 10.7844 4.66376 9.30975 numMergedOcc 0
25 mol 226 unq 1 iso 0 dist 7.04477 5.47434 6.11704 10.7844 4.66376 9.14028 numMergedOcc 0
26 mol 244 unq 0 iso 0 dist 8.08939 11.6777 5.50492 11.1378 4.89551 9.21656 numMergedOcc 0
27 mol 244 unq 1 iso 0 dist 7.33574 7.45211 5.50492 11.909 4.89551 9.21656 numMergedOcc 0
28 mol 249 unq 0 iso 0 dist 6.58109 9.9244 5.48118 11.5106 9.55793 6.26142 numMergedOcc 0
29 mol 258 unq 0 iso 0 dist 8.63176 8.27707 9.63959 11.4159 12.7787 7.57187 numMergedOcc 0
30 mol 287 unq 0 iso 0 dist 7.76945 7.19628 9.65934 12.7673 9.62532 7.7743 numMergedOcc 0
31 mol 288 unq 0 iso 0 dist 7.76945 7.19628 9.65934 12.7673 9.62532 7.7743 numMergedOcc 0
32 mol 289 unq 0 iso 0 dist 7.76945 7.19628 9.65934 12.7673 9.62532 7.7743 numMergedOcc 0
