0 mol 7 unq 0 iso 0 dist 8.88982 13.9585 7.10621 12.5757 4.87279 8.70159 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.8576 10.4545 8.41585 13.5257 10.6847 6.28925 numMergedOcc 0
2 mol 51 unq 0 iso 0 dist 8.99612 10.2637 9.0709 13.18 11.0025 7.52921 numMergedOcc 0
3 mol 54 unq 0 iso 0 dist 6.13476 13.1047 9.5589 13.6142 8.17454 7.56581 numMergedOcc 0
4 mol 54 unq 1 iso 0 dist 6.13476 10.0565 6.83299 13.6142 8.17454 9.22021 numMergedOcc 0
5 mol 85 unq 0 iso 0 dist 7.59073 4.53858 5.73196 6.31828 7.43006 5.62635 numMergedOcc 0
6 mol 85 unq 1 iso 0 dist 7.59073 4.53858 5.73196 7.00884 4.60756 7.07868 numMergedOcc 0
7 mol 113 unq 0 iso 0 dist 8.29529 7.77295 5.86073 12.5755 5.05071 8.57673 numMergedOcc 0
8 mol 117 unq 0 iso 0 dist 9.60425 5.17524 9.84395 7.38304 10.0324 8.2236 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 8.94909 8.76089 7.11802 9.95052 6.56917 9.64695 numMergedOcc 0
10 mol 133 unq 1 iso 0 dist 8.94909 6.80087 8.00618 9.95052 6.56917 4.51266 numMergedOcc 0
11 mol 178 unq 0 iso 0 dist 7.14849 14.0459 7.17202 12.4387 6.39077 7.12045 numMergedOcc 0
12 mol 178 unq 1 iso 0 dist 7.14849 14.3001 8.81551 12.4387 6.39077 8.94945 numMergedOcc 0
13 mol 178 unq 2 iso 0 dist 8.63718 5.91018 7.17202 11.5346 6.39077 7.12045 numMergedOcc 0
14 mol 178 unq 3 iso 0 dist 8.63718 4.92895 8.81551 11.5346 6.39077 8.94945 numMergedOcc 0
15 mol 181 unq 0 iso 0 dist 9.50454 11.755 7.63312 8.5489 5.83639 8.47008 numMergedOcc 0
16 mol 181 unq 1 iso 0 dist 6.43406 10.9813 7.81386 13.8136 7.45927 8.47008 numMergedOcc 0
17 mol 181 unq 2 iso 0 dist 8.80581 10.209 7.63312 14.1796 5.83639 8.47008 numMergedOcc 0
18 mol 205 unq 0 iso 0 dist 6.04106 12.9245 7.26832 12.3881 7.36565 6.52987 numMergedOcc 0
19 mol 229 unq 0 iso 0 dist 8.52933 10.568 9.06952 9.54743 4.74734 7.38552 numMergedOcc 0
20 mol 234 unq 0 iso 0 dist 7.17032 5.44278 6.56247 12.4395 8.83842 7.72403 numMergedOcc 0
21 mol 234 unq 1 iso 0 dist 7.17032 9.25445 9.45496 12.4395 8.83842 6.35438 numMergedOcc 0
22 mol 239 unq 0 iso 0 dist 6.92721 9.00069 6.16342 13.326 9.26426 6.8597 numMergedOcc 0
23 mol 248 unq 0 iso 0 dist 9.5107 6.97887 7.21521 7.53088 5.41499 9.12664 numMergedOcc 0
24 mol 248 unq 1 iso 0 dist 9.5107 5.78576 8.2965 7.53088 5.41499 6.51383 numMergedOcc 0
25 mol 258 unq 0 iso 0 dist 5.31858 6.60345 6.42289 13.3571 10.8069 8.14531 numMergedOcc 0
