0 mol 13 unq 0 iso 0 dist 7.39086 9.45635 4.0489 5.43688 8.47514 12.0737 numMergedOcc 0
1 mol 24 unq 0 iso 0 dist 6.48457 8.09311 13.862 14.6259 8.80127 20.3516 numMergedOcc 0
2 mol 24 unq 1 iso 0 dist 6.48457 9.05357 9.94168 14.6259 8.80127 12.5061 numMergedOcc 0
3 mol 43 unq 0 iso 0 dist 9.07906 6.75943 11.2174 10.6953 8.75567 16.3383 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 9.854 9.69044 10.4612 5.80772 8.23749 13.6127 numMergedOcc 0
5 mol 85 unq 0 iso 0 dist 8.81824 7.7068 9.85117 5.42586 8.77199 10.2413 numMergedOcc 0
6 mol 89 unq 0 iso 0 dist 6.64584 6.53308 4.47717 5.38878 9.66138 11.4043 numMergedOcc 0
7 mol 89 unq 1 iso 0 dist 6.64584 7.47974 7.41309 5.38878 9.66138 10.4972 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 9.50837 7.79505 12.7979 4.48524 7.46793 11.7484 numMergedOcc 0
9 mol 127 unq 1 iso 0 dist 8.17522 7.79505 5.83338 6.16471 8.82676 11.5667 numMergedOcc 0
10 mol 127 unq 2 iso 0 dist 8.17522 7.79505 5.83338 6.55997 8.14341 7.36199 numMergedOcc 0
11 mol 127 unq 3 iso 0 dist 8.17522 7.79505 5.83338 12.4623 6.54744 11.2944 numMergedOcc 0
12 mol 127 unq 4 iso 0 dist 8.14341 7.36199 5.83338 11.2106 8.82676 11.5667 numMergedOcc 0
13 mol 127 unq 5 iso 0 dist 8.14341 7.36199 5.83338 6.55997 8.17522 7.79505 numMergedOcc 0
14 mol 127 unq 6 iso 0 dist 8.14341 7.36199 5.83338 9.8922 6.54744 11.2944 numMergedOcc 0
15 mol 152 unq 0 iso 0 dist 8.86966 6.70693 10.8368 5.49936 5.7527 10.4895 numMergedOcc 0
16 mol 167 unq 0 iso 0 dist 6.85239 7.68266 6.15234 4.70068 5.72735 9.2289 numMergedOcc 0
17 mol 167 unq 1 iso 0 dist 6.85239 6.84752 5.75062 4.70068 5.72735 7.02548 numMergedOcc 0
18 mol 167 unq 2 iso 0 dist 5.72735 7.20495 6.09401 4.70068 6.85239 10.5499 numMergedOcc 0
19 mol 167 unq 3 iso 0 dist 5.72735 9.2289 6.15234 4.70068 6.85239 7.68266 numMergedOcc 0
20 mol 167 unq 4 iso 0 dist 5.72735 7.02548 5.75062 4.70068 6.85239 6.84752 numMergedOcc 0
21 mol 178 unq 0 iso 0 dist 8.4173 7.06025 7.86021 11.7381 6.55543 13.2692 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 9.37545 9.3498 4.4877 6.83796 6.02579 7.05695 numMergedOcc 0
23 mol 186 unq 1 iso 0 dist 6.02579 7.05695 4.4877 6.83796 9.37545 9.3498 numMergedOcc 0
24 mol 219 unq 0 iso 0 dist 7.68645 4.33238 6.08582 7.02195 5.75017 7.83604 numMergedOcc 0
25 mol 219 unq 1 iso 0 dist 7.68645 4.33238 6.08582 13.4387 6.12768 11.734 numMergedOcc 0
26 mol 219 unq 2 iso 0 dist 7.68645 4.33238 6.08582 10.8119 7.19159 10.9627 numMergedOcc 0
27 mol 219 unq 3 iso 0 dist 5.75017 7.83604 6.08582 7.02195 7.68645 4.33238 numMergedOcc 0
28 mol 219 unq 4 iso 0 dist 5.75017 7.83604 6.08582 10.7348 6.12768 11.734 numMergedOcc 0
29 mol 219 unq 5 iso 0 dist 5.75017 7.83604 6.08582 10.6748 7.19159 10.9627 numMergedOcc 0
