0 mol 10 unq 0 iso 0 dist 8.93461 11.0871 9.78153 18.299 14.8787 8.16906 numMergedOcc 0
1 mol 43 unq 0 iso 0 dist 9.76585 11.3999 7.21995 13.5968 3.83842 8.81562 numMergedOcc 0
2 mol 48 unq 0 iso 0 dist 9.04514 9.66389 5.35252 14.4979 6.44604 7.99434 numMergedOcc 0
3 mol 48 unq 1 iso 0 dist 9.14072 9.90363 5.06188 14.9479 6.4561 8.10222 numMergedOcc 0
4 mol 61 unq 0 iso 0 dist 7.94667 4.09314 7.11706 10.2336 3.80737 9.0681 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 8.92491 14.685 7.48127 16.1417 8.58474 5.91098 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 7.41861 4.00834 7.48127 6.46582 8.58474 5.91098 numMergedOcc 0
7 mol 79 unq 0 iso 0 dist 5.55798 6.05149 8.64686 7.06029 4.13187 6.65972 numMergedOcc 0
8 mol 79 unq 1 iso 0 dist 5.55798 6.05149 8.64686 8.97789 9.13196 4.2253 numMergedOcc 0
9 mol 83 unq 0 iso 0 dist 6.77845 9.39588 7.2118 9.94528 4.48523 7.69755 numMergedOcc 0
10 mol 83 unq 1 iso 0 dist 5.48555 12.0034 7.2118 8.94777 4.48523 7.69755 numMergedOcc 0
11 mol 83 unq 2 iso 0 dist 5.39805 6.61275 7.2118 9.28583 4.48523 7.69755 numMergedOcc 0
12 mol 92 unq 0 iso 0 dist 9.29249 9.44377 7.70612 7.33353 4.51052 8.01266 numMergedOcc 0
13 mol 116 unq 0 iso 0 dist 9.62357 15.1223 6.61973 16.1417 8.63935 9.12145 numMergedOcc 0
14 mol 116 unq 1 iso 0 dist 9.62357 15.1223 6.61973 12.5795 4.10222 8.11048 numMergedOcc 0
15 mol 129 unq 0 iso 0 dist 6.65878 5.0466 7.6453 7.84813 6.61102 4.4077 numMergedOcc 0
16 mol 129 unq 1 iso 0 dist 6.65878 5.0466 7.6453 12.1544 9.0678 8.4874 numMergedOcc 0
17 mol 133 unq 0 iso 0 dist 6.9268 8.75242 5.79195 4.82356 4.63862 9.35049 numMergedOcc 0
18 mol 133 unq 1 iso 0 dist 8.19166 6.45333 5.79195 8.83476 4.63862 9.35049 numMergedOcc 0
19 mol 167 unq 0 iso 0 dist 6.28957 5.44954 7.20545 11.31 6.87479 8.43955 numMergedOcc 0
20 mol 167 unq 1 iso 0 dist 7.34285 9.15105 7.20545 13.706 6.87479 8.43955 numMergedOcc 0
21 mol 170 unq 0 iso 0 dist 9.05865 9.56212 8.10386 13.317 6.72402 6.7638 numMergedOcc 0
22 mol 186 unq 0 iso 0 dist 6.36789 12.6035 6.72718 15.1522 9.57585 9.12589 numMergedOcc 0
23 mol 192 unq 0 iso 0 dist 5.21088 4.65303 7.36571 5.05414 3.9335 5.03588 numMergedOcc 0
24 mol 192 unq 1 iso 0 dist 8.25609 4.65303 9.17137 5.05414 10.6087 5.03588 numMergedOcc 0
25 mol 195 unq 0 iso 0 dist 9.04342 4.03375 5.61326 12.0608 8.51428 9.16422 numMergedOcc 0
26 mol 205 unq 0 iso 0 dist 8.47833 11.2438 6.43519 8.93485 6.82382 8.83628 numMergedOcc 0
27 mol 205 unq 1 iso 0 dist 5.47586 7.47443 6.43519 5.66636 6.82382 8.83628 numMergedOcc 0
28 mol 214 unq 0 iso 0 dist 7.08083 6.46773 4.36421 13.9789 13.6384 9.53899 numMergedOcc 0
29 mol 230 unq 0 iso 0 dist 5.19913 6.28086 9.24729 6.99256 3.86973 8.01593 numMergedOcc 0
30 mol 258 unq 0 iso 0 dist 8.53084 11.0749 8.58092 11.7986 5.05766 5.94328 numMergedOcc 0
31 mol 258 unq 1 iso 0 dist 8.53084 5.81432 7.40014 11.7986 5.05766 7.91978 numMergedOcc 0
32 mol 258 unq 2 iso 0 dist 5.9223 9.26732 8.58092 6.61322 5.05766 5.94328 numMergedOcc 0
33 mol 258 unq 3 iso 0 dist 5.9223 6.72414 7.40014 6.61322 5.05766 7.91978 numMergedOcc 0
34 mol 258 unq 4 iso 0 dist 8.17026 6.30651 5.53369 15.5269 9.41237 9.48672 numMergedOcc 0
35 mol 258 unq 5 iso 0 dist 8.43002 6.30651 8.57274 15.5269 13.3588 9.48672 numMergedOcc 0
36 mol 285 unq 0 iso 0 dist 7.38536 6.37482 6.32984 5.28731 3.57803 7.08681 numMergedOcc 0
37 mol 285 unq 1 iso 0 dist 7.38536 6.37482 6.32984 10.1649 11.1099 4.95596 numMergedOcc 0
38 mol 285 unq 2 iso 0 dist 7.38536 6.37482 6.32984 11.3128 11.5761 6.3508 numMergedOcc 0
39 mol 285 unq 3 iso 0 dist 7.38536 6.37482 6.32984 14.2549 11.5053 8.3005 numMergedOcc 0
40 mol 287 unq 0 iso 0 dist 6.19545 5.27724 5.15923 13.963 8.69518 9.77996 numMergedOcc 0
41 mol 287 unq 1 iso 0 dist 6.19545 5.27724 5.15923 9.83733 4.11753 6.61308 numMergedOcc 0
42 mol 287 unq 2 iso 0 dist 6.19545 5.27724 5.15923 6.16127 4.00861 6.25845 numMergedOcc 0
43 mol 287 unq 3 iso 0 dist 7.3388 5.66584 6.96774 6.16127 5.03775 9.31611 numMergedOcc 0
44 mol 287 unq 4 iso 0 dist 6.96248 5.66584 7.14859 6.16127 8.95194 9.31611 numMergedOcc 0
45 mol 288 unq 0 iso 0 dist 6.19545 5.27724 5.15923 13.963 8.69518 9.77996 numMergedOcc 0
46 mol 288 unq 1 iso 0 dist 6.19545 5.27724 5.15923 9.83733 4.11753 6.61308 numMergedOcc 0
47 mol 288 unq 2 iso 0 dist 6.19545 5.27724 5.15923 6.16127 4.00861 6.25845 numMergedOcc 0
48 mol 288 unq 3 iso 0 dist 7.3388 5.66584 6.96774 6.16127 5.03775 9.31611 numMergedOcc 0
49 mol 288 unq 4 iso 0 dist 6.96248 5.66584 7.14859 6.16127 8.95194 9.31611 numMergedOcc 0
50 mol 289 unq 0 iso 0 dist 6.19545 5.27724 5.15923 13.963 8.69518 9.77996 numMergedOcc 0
51 mol 289 unq 1 iso 0 dist 6.19545 5.27724 5.15923 9.83733 4.11753 6.61308 numMergedOcc 0
52 mol 289 unq 2 iso 0 dist 6.19545 5.27724 5.15923 6.16127 4.00861 6.25845 numMergedOcc 0
53 mol 289 unq 3 iso 0 dist 7.3388 5.66584 6.96774 6.16127 5.03775 9.31611 numMergedOcc 0
54 mol 289 unq 4 iso 0 dist 6.96248 5.66584 7.14859 6.16127 8.95194 9.31611 numMergedOcc 0
55 mol 293 unq 0 iso 0 dist 8.04021 6.89397 9.65156 10.5448 5.43383 8.84292 numMergedOcc 0
56 mol 294 unq 0 iso 0 dist 9.4943 5.71611 6.37998 12.1408 3.33848 7.94656 numMergedOcc 0
