0 mol 9 unq 0 iso 0 dist 8.61976 4.75533 9.95911 14.9755 9.58546 16.5076 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 8.61976 5.85081 7.19188 14.9755 9.58546 11.2529 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 9.29504 7.83083 15.0188 12.4306 7.43211 17.4395 numMergedOcc 0
3 mol 10 unq 1 iso 0 dist 9.29504 7.83083 15.0188 13.1091 4.77146 18.7596 numMergedOcc 0
4 mol 10 unq 2 iso 0 dist 9.29504 6.90469 12.4341 12.4306 7.43211 14.4454 numMergedOcc 0
5 mol 10 unq 3 iso 0 dist 9.29504 6.90469 12.4341 13.1091 4.77146 15.8557 numMergedOcc 0
6 mol 10 unq 4 iso 0 dist 9.78153 8.16906 14.8787 7.9863 7.33568 14.0073 numMergedOcc 0
7 mol 30 unq 0 iso 0 dist 8.204 7.88072 3.90342 5.33828 5.98814 6.64571 numMergedOcc 0
8 mol 30 unq 1 iso 0 dist 8.204 7.88072 3.90342 9.71315 7.00096 9.56112 numMergedOcc 0
9 mol 48 unq 0 iso 0 dist 5.35252 7.99434 6.44604 4.21871 8.33835 7.5109 numMergedOcc 0
10 mol 48 unq 1 iso 0 dist 9.53081 5.43913 13.4515 9.26625 6.63256 14.5851 numMergedOcc 0
11 mol 48 unq 2 iso 0 dist 9.53081 8.26877 17.6258 9.26625 6.63256 17.0193 numMergedOcc 0
12 mol 48 unq 3 iso 0 dist 5.06188 8.10222 6.4561 4.18233 8.10589 7.71747 numMergedOcc 0
13 mol 83 unq 0 iso 0 dist 7.2118 7.69755 4.48523 15.1346 8.30234 11.4754 numMergedOcc 0
14 mol 83 unq 1 iso 0 dist 7.2118 7.69755 4.48523 7.62278 8.55182 10.1316 numMergedOcc 0
15 mol 83 unq 2 iso 0 dist 7.2118 7.69755 4.48523 6.62382 9.57166 7.03753 numMergedOcc 0
16 mol 91 unq 0 iso 0 dist 8.91354 8.91998 10.8497 15.2135 7.29486 16.2802 numMergedOcc 0
17 mol 92 unq 0 iso 0 dist 7.70612 8.01266 4.51052 4.77825 8.97594 11.2636 numMergedOcc 0
18 mol 170 unq 0 iso 0 dist 8.10386 6.7638 6.72402 8.25477 8.00057 10.6907 numMergedOcc 0
19 mol 170 unq 1 iso 0 dist 8.10386 6.7638 6.72402 5.89513 5.98926 9.56192 numMergedOcc 0
20 mol 214 unq 0 iso 0 dist 5.86911 9.46274 14.085 6.30909 8.85146 14.6007 numMergedOcc 0
21 mol 224 unq 0 iso 0 dist 7.11741 6.06793 3.40786 6.05333 9.40666 6.27358 numMergedOcc 0
22 mol 224 unq 1 iso 0 dist 8.8113 6.06793 5.77577 6.05333 8.91726 6.27358 numMergedOcc 0
23 mol 224 unq 2 iso 0 dist 8.8113 6.06793 5.77577 10.8317 9.4029 10.5027 numMergedOcc 0
24 mol 239 unq 0 iso 0 dist 8.86185 7.24545 13.8399 13.4378 7.78398 19.3353 numMergedOcc 0
25 mol 258 unq 0 iso 0 dist 8.58092 5.94328 5.05766 9.99301 8.73291 10.0158 numMergedOcc 0
26 mol 258 unq 1 iso 0 dist 7.40014 7.91978 5.05766 5.23156 8.73291 10.0158 numMergedOcc 0
