0 mol 7 unq 0 iso 0 dist 9.49232 9.34656 6.58295 16.3136 9.60361 8.81608 numMergedOcc 0
1 mol 113 unq 0 iso 0 dist 9.92308 8.94447 14.6319 11.2557 17.5729 5.29949 numMergedOcc 0
2 mol 133 unq 0 iso 0 dist 8.86332 9.59094 6.27514 13.2035 8.64976 9.10003 numMergedOcc 0
3 mol 134 unq 0 iso 0 dist 9.17599 5.98435 6.19899 4.72407 11.9375 6.44575 numMergedOcc 0
4 mol 134 unq 1 iso 0 dist 9.17599 5.98435 6.19899 7.97297 12.7756 7.43401 numMergedOcc 0
5 mol 134 unq 2 iso 0 dist 9.17599 8.80672 14.2573 6.67639 12.9653 5.73203 numMergedOcc 0
6 mol 134 unq 3 iso 0 dist 9.17599 8.80672 14.2573 4.4987 13.2775 6.57379 numMergedOcc 0
7 mol 134 unq 4 iso 0 dist 8.78704 5.98435 11.2567 4.72407 13.3788 6.44575 numMergedOcc 0
8 mol 134 unq 5 iso 0 dist 8.78704 5.98435 11.2567 7.97297 14.2857 7.43401 numMergedOcc 0
9 mol 134 unq 6 iso 0 dist 8.78704 8.80672 11.0666 6.67639 13.0619 5.73203 numMergedOcc 0
10 mol 134 unq 7 iso 0 dist 8.78704 8.80672 11.0666 4.4987 11.2202 6.57379 numMergedOcc 0
11 mol 141 unq 0 iso 0 dist 8.49149 9.55297 12.811 11.0797 17.9297 7.54341 numMergedOcc 0
12 mol 148 unq 0 iso 0 dist 9.31479 6.91289 4.97291 8.23396 12.8771 8.42899 numMergedOcc 0
13 mol 148 unq 1 iso 0 dist 9.52076 6.91289 10.4145 8.23396 13.0478 8.42899 numMergedOcc 0
14 mol 150 unq 0 iso 0 dist 9.50019 6.895 4.97546 7.40922 12.7578 8.33721 numMergedOcc 0
15 mol 150 unq 1 iso 0 dist 9.44178 6.895 10.5147 7.40922 12.9776 8.33721 numMergedOcc 0
16 mol 214 unq 0 iso 0 dist 8.61758 8.20906 12.6724 5.055 12.9113 9.58372 numMergedOcc 0
17 mol 214 unq 1 iso 0 dist 5.45548 8.20906 5.23668 5.055 8.70011 9.58372 numMergedOcc 0
18 mol 233 unq 0 iso 0 dist 5.68392 5.34745 4.91634 6.49444 11.3925 8.24424 numMergedOcc 0
19 mol 233 unq 1 iso 0 dist 5.68392 5.34745 4.91634 6.63339 10.8345 7.0942 numMergedOcc 0
20 mol 233 unq 2 iso 0 dist 5.68392 5.34745 4.91634 9.86764 10.8592 6.01775 numMergedOcc 0
21 mol 260 unq 0 iso 0 dist 8.79321 6.29389 11.1468 12.978 19.5204 8.5613 numMergedOcc 0
22 mol 272 unq 0 iso 0 dist 8.99817 6.27189 12.1152 13.4399 15.3687 8.84523 numMergedOcc 0
23 mol 272 unq 1 iso 0 dist 8.99817 6.27189 12.1152 5.87335 9.5294 6.95241 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 6.2587 8.70062 9.81184 9.8719 7.74312 8.59762 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 6.2587 8.70062 9.81184 9.8719 7.74312 8.59762 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 6.2587 8.70062 9.81184 9.8719 7.74312 8.59762 numMergedOcc 0
