0 mol 30 unq 0 iso 0 dist 8.204 7.88072 3.90342 4.83638 9.11745 9.63882 4.5844 7.13565 8.67216 3.08756 numMergedOcc 0
1 mol 30 unq 1 iso 0 dist 8.204 7.88072 3.90342 5.2103 4.62145 6.87277 4.5844 7.13565 8.67216 3.30447 numMergedOcc 0
2 mol 30 unq 2 iso 0 dist 8.204 7.88072 3.90342 14.1481 9.71995 11.3258 4.5844 7.13565 8.67216 10.8938 numMergedOcc 0
3 mol 48 unq 0 iso 0 dist 9.40644 7.99434 3.85292 8.12843 7.33788 4.22002 5.76698 10.4843 7.78689 4.88527 numMergedOcc 0
4 mol 48 unq 1 iso 0 dist 9.40644 7.99434 3.85292 9.72202 9.74351 8.10774 5.76698 10.4843 7.78689 5.56357 numMergedOcc 0
5 mol 48 unq 2 iso 0 dist 9.40644 7.99434 3.85292 12.7252 7.36877 6.5241 5.76698 10.4843 7.78689 9.94951 numMergedOcc 0
6 mol 48 unq 3 iso 0 dist 5.35252 7.99434 6.44604 8.12843 8.52681 4.22002 5.76698 8.8645 7.78689 4.88527 numMergedOcc 0
7 mol 48 unq 4 iso 0 dist 5.35252 7.99434 6.44604 9.72202 9.98769 8.10774 5.76698 8.8645 7.78689 5.56357 numMergedOcc 0
8 mol 48 unq 5 iso 0 dist 9.53081 8.26877 17.6258 15.1442 7.90416 23.1493 12.0497 20.92 7.78689 25.8785 numMergedOcc 0
9 mol 48 unq 6 iso 0 dist 9.53081 8.26877 17.6258 4.89976 9.74553 11.1156 12.0497 20.92 7.78689 11.6778 numMergedOcc 0
10 mol 48 unq 7 iso 0 dist 5.06188 8.10222 6.4561 9.57893 9.40291 8.14245 5.75684 8.3491 7.70645 5.43784 numMergedOcc 0
11 mol 48 unq 8 iso 0 dist 5.06188 8.10222 6.4561 7.88988 7.94814 4.17933 5.75684 8.3491 7.70645 4.57947 numMergedOcc 0
12 mol 48 unq 9 iso 0 dist 5.06188 8.10222 6.4561 8.00934 9.55632 5.54893 5.75684 8.3491 7.70645 4.60843 numMergedOcc 0
13 mol 63 unq 0 iso 0 dist 6.49343 7.85738 12.6017 4.44607 6.42443 9.13228 5.82517 10.9406 8.78414 10.1907 numMergedOcc 0
14 mol 76 unq 0 iso 0 dist 7.48127 5.91098 8.58474 11.6853 9.50939 7.66068 13.363 16.1719 9.57759 9.50354 numMergedOcc 0
15 mol 78 unq 0 iso 0 dist 9.86325 6.11101 7.86077 7.38398 7.50229 8.61143 7.35151 11.2839 9.38837 4.315 numMergedOcc 0
16 mol 78 unq 1 iso 0 dist 9.86325 6.11101 7.86077 7.38398 7.50229 8.61143 4.76634 10.4541 9.80913 9.00868 numMergedOcc 0
17 mol 83 unq 0 iso 0 dist 7.2118 7.69755 4.48523 4.12785 5.13041 7.50925 4.93836 5.25361 5.35861 3.62753 numMergedOcc 0
18 mol 90 unq 0 iso 0 dist 9.06641 8.63446 6.65219 4.77556 7.01987 5.24346 6.55381 12.0429 7.62463 5.4118 numMergedOcc 0
19 mol 127 unq 0 iso 0 dist 5.83719 9.64136 11.1718 3.75302 8.95465 12.5142 9.74982 14.5858 8.09691 10.1848 numMergedOcc 0
20 mol 143 unq 0 iso 0 dist 5.40826 5.33772 3.66518 5.80693 9.31435 10.8164 7.11802 9.78214 6.60366 12.3412 numMergedOcc 0
21 mol 143 unq 1 iso 0 dist 5.40826 5.33772 3.66518 5.08025 6.38786 4.3855 7.11802 9.78214 6.60366 5.94217 numMergedOcc 0
22 mol 214 unq 0 iso 0 dist 4.36421 9.53899 13.6384 9.91172 9.96715 16.4793 10.0389 14.1246 7.66702 12.5768 numMergedOcc 0
23 mol 266 unq 0 iso 0 dist 9.0836 6.48382 7.63149 7.52317 6.39822 8.25286 7.90149 8.9221 8.20376 3.14784 numMergedOcc 0
24 mol 266 unq 1 iso 0 dist 9.0836 6.48382 7.63149 9.52953 5.36518 9.9965 7.90149 8.9221 8.20376 5.95721 numMergedOcc 0
25 mol 266 unq 2 iso 0 dist 9.62494 6.48382 4.39553 5.79323 9.90506 6.96692 7.90149 9.51145 8.20376 3.68488 numMergedOcc 0
26 mol 266 unq 3 iso 0 dist 9.62494 6.48382 4.39553 7.52317 8.61077 8.25286 7.90149 9.51145 8.20376 3.14784 numMergedOcc 0
27 mol 266 unq 4 iso 0 dist 9.62494 6.48382 4.39553 9.52953 9.11585 9.9965 7.90149 9.51145 8.20376 5.95721 numMergedOcc 0
28 mol 277 unq 0 iso 0 dist 8.15119 4.1545 9.21484 5.11865 9.07744 7.98956 6.65084 6.42951 5.13533 10.5214 numMergedOcc 0
