0 mol 5 unq 0 iso 0 dist 8.89306 3.81534 6.14476 11.2967 13.9409 9.70883 numMergedOcc 0
1 mol 5 unq 1 iso 0 dist 8.89306 3.81534 6.14476 11.6112 4.97032 9.65565 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 9.86627 10.7471 9.45756 13.6178 9.26597 3.77542 numMergedOcc 0
3 mol 46 unq 1 iso 0 dist 9.86627 10.7471 9.45756 11.1654 4.60014 9.97314 numMergedOcc 0
4 mol 72 unq 0 iso 0 dist 8.4143 3.63735 6.62699 8.5781 10.3016 6.79423 numMergedOcc 0
5 mol 72 unq 1 iso 0 dist 9.58834 3.63735 8.98867 8.5781 9.35725 6.79423 numMergedOcc 0
6 mol 78 unq 0 iso 0 dist 5.68286 7.92963 7.69072 10.009 5.34874 8.42738 numMergedOcc 0
7 mol 78 unq 1 iso 0 dist 5.68286 7.92963 7.69072 7.50229 3.68023 8.79979 numMergedOcc 0
8 mol 79 unq 0 iso 0 dist 8.0139 4.15002 5.25027 6.64921 3.83059 4.15789 numMergedOcc 0
9 mol 79 unq 1 iso 0 dist 8.0139 9.36535 4.37025 12.9584 8.95695 6.20144 numMergedOcc 0
10 mol 79 unq 2 iso 0 dist 8.0139 9.36535 4.37025 6.64921 3.83059 4.808 numMergedOcc 0
11 mol 85 unq 0 iso 0 dist 9.67557 4.21164 8.04242 8.00314 8.37717 4.18248 numMergedOcc 0
12 mol 109 unq 0 iso 0 dist 9.64641 4.41479 8.11702 12.2145 4.56372 9.29327 numMergedOcc 0
13 mol 117 unq 0 iso 0 dist 9.32858 5.24084 7.78789 12.2808 4.46691 9.02015 numMergedOcc 0
14 mol 122 unq 0 iso 0 dist 8.75778 6.39355 4.42563 14.1815 6.34716 8.565 numMergedOcc 0
15 mol 168 unq 0 iso 0 dist 8.41715 3.60864 7.48734 5.64732 3.42733 5.86767 numMergedOcc 0
16 mol 168 unq 1 iso 0 dist 8.41715 3.60864 7.48734 5.52214 8.91606 5.28353 numMergedOcc 0
17 mol 168 unq 2 iso 0 dist 7.79893 3.60864 5.6125 5.64732 6.57536 5.86767 numMergedOcc 0
18 mol 168 unq 3 iso 0 dist 7.79893 3.60864 5.6125 5.52214 4.07587 5.28353 numMergedOcc 0
19 mol 206 unq 0 iso 0 dist 8.11407 3.98316 4.51255 10.4918 4.46135 6.80296 numMergedOcc 0
20 mol 206 unq 1 iso 0 dist 8.95375 3.98316 6.23183 10.4918 3.56132 6.80296 numMergedOcc 0
21 mol 206 unq 2 iso 0 dist 9.29007 13.2719 6.23183 11.1494 3.56132 6.80296 numMergedOcc 0
22 mol 253 unq 0 iso 0 dist 8.82388 10.7148 5.77511 17.1206 10.0874 8.66299 numMergedOcc 0
23 mol 277 unq 0 iso 0 dist 4.81916 9.21484 4.9764 9.07744 7.75371 7.98956 numMergedOcc 0
24 mol 277 unq 1 iso 0 dist 4.81916 10.3506 6.36559 9.07744 7.75371 5.86185 numMergedOcc 0
25 mol 287 unq 0 iso 0 dist 7.7743 5.13698 5.30118 5.55176 3.65199 4.68668 numMergedOcc 0
26 mol 287 unq 1 iso 0 dist 8.71506 5.13698 8.98698 5.55176 5.70614 4.68668 numMergedOcc 0
27 mol 288 unq 0 iso 0 dist 7.7743 5.13698 5.30118 5.55176 3.65199 4.68668 numMergedOcc 0
28 mol 288 unq 1 iso 0 dist 8.71506 5.13698 8.98698 5.55176 5.70614 4.68668 numMergedOcc 0
29 mol 289 unq 0 iso 0 dist 7.7743 5.13698 5.30118 5.55176 3.65199 4.68668 numMergedOcc 0
30 mol 289 unq 1 iso 0 dist 8.71506 5.13698 8.98698 5.55176 5.70614 4.68668 numMergedOcc 0
