0 mol 30 unq 0 iso 0 dist 6.30807 9.83449 12.0998 4.38332 8.51496 13.8716 numMergedOcc 0
1 mol 41 unq 0 iso 0 dist 8.6783 9.3808 8.79418 7.85477 5.31016 12.3771 numMergedOcc 0
2 mol 43 unq 0 iso 0 dist 8.60396 7.86479 4.89928 10.6703 9.38335 12.6221 numMergedOcc 0
3 mol 58 unq 0 iso 0 dist 5.35101 9.1791 7.4999 4.7391 5.84625 7.58739 numMergedOcc 0
4 mol 58 unq 1 iso 0 dist 5.35101 6.86485 4.99692 4.7391 5.84625 9.01564 numMergedOcc 0
5 mol 58 unq 2 iso 0 dist 5.35101 8.37546 3.70586 4.7391 5.84625 7.11065 numMergedOcc 0
6 mol 58 unq 3 iso 0 dist 8.68381 8.26586 7.4999 4.35705 5.84625 7.58739 numMergedOcc 0
7 mol 58 unq 4 iso 0 dist 8.68381 9.76234 4.99692 4.35705 5.84625 9.01564 numMergedOcc 0
8 mol 69 unq 0 iso 0 dist 7.17678 9.18161 4.69809 6.26461 8.91502 11.4374 numMergedOcc 0
9 mol 91 unq 0 iso 0 dist 7.62621 6.64714 6.44712 5.75219 5.51406 8.77355 numMergedOcc 0
10 mol 93 unq 0 iso 0 dist 8.84466 9.43355 3.91263 16.0131 7.4518 7.28831 numMergedOcc 0
11 mol 93 unq 1 iso 0 dist 8.84466 9.43355 3.91263 11.7408 9.1687 9.71411 numMergedOcc 0
12 mol 93 unq 2 iso 0 dist 8.84466 5.64141 5.59024 16.0131 7.4518 11.6193 numMergedOcc 0
13 mol 93 unq 3 iso 0 dist 8.84466 5.64141 5.59024 11.7408 9.1687 12.2183 numMergedOcc 0
14 mol 93 unq 4 iso 0 dist 8.84466 5.46186 12.9872 16.0131 7.4518 19.8987 numMergedOcc 0
15 mol 93 unq 5 iso 0 dist 8.84466 5.46186 12.9872 11.7408 9.1687 11.9145 numMergedOcc 0
16 mol 115 unq 0 iso 0 dist 7.99121 9.26505 12.8905 10.6956 6.66022 15.1135 numMergedOcc 0
17 mol 133 unq 0 iso 0 dist 9.22456 7.33743 5.68827 8.11294 9.04845 8.83732 numMergedOcc 0
18 mol 133 unq 1 iso 0 dist 5.7232 7.33743 11.5628 8.11294 6.72323 8.83732 numMergedOcc 0
19 mol 146 unq 0 iso 0 dist 5.3184 6.76896 10.5314 9.68961 7.13378 15.8734 numMergedOcc 0
20 mol 169 unq 0 iso 0 dist 8.56204 8.66311 14.9735 5.82243 5.51388 9.68143 numMergedOcc 0
21 mol 181 unq 0 iso 0 dist 8.94464 9.19831 7.88733 6.15536 9.07527 8.59681 numMergedOcc 0
22 mol 181 unq 1 iso 0 dist 8.63713 9.19831 5.76612 10.5886 8.63119 10.81 numMergedOcc 0
23 mol 278 unq 0 iso 0 dist 8.78758 9.90216 3.58134 4.19643 9.21145 11.1004 numMergedOcc 0
24 mol 292 unq 0 iso 0 dist 5.76223 9.18386 11.4255 4.34945 6.68863 13.4707 numMergedOcc 0
