0 mol 5 unq 0 iso 0 dist 5.2392 4.9568 3.33561 8.54255 9.13355 11.6542 numMergedOcc 0
1 mol 26 unq 0 iso 0 dist 9.63803 7.89667 8.86888 13.9089 9.56639 16.8864 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 8.55202 8.79378 9.44812 8.85515 6.03151 11.1221 numMergedOcc 0
3 mol 76 unq 0 iso 0 dist 6.63973 6.46582 3.35924 15.1383 9.78762 12.7979 numMergedOcc 0
4 mol 79 unq 0 iso 0 dist 8.59739 7.06029 5.70329 12.7438 6.63733 12.2512 numMergedOcc 0
5 mol 98 unq 0 iso 0 dist 7.34638 9.68556 11.0062 11.1108 4.79891 15.3957 numMergedOcc 0
6 mol 109 unq 0 iso 0 dist 6.67635 6.3323 3.54756 5.60821 5.58623 7.68838 numMergedOcc 0
7 mol 129 unq 0 iso 0 dist 6.53559 7.04904 12.7725 8.56696 8.46972 13.9608 numMergedOcc 0
8 mol 129 unq 1 iso 0 dist 6.53559 5.06053 10.2785 8.56696 8.46972 13.0642 numMergedOcc 0
9 mol 129 unq 2 iso 0 dist 8.09774 7.84813 9.87781 9.22336 8.46972 15.6733 numMergedOcc 0
10 mol 168 unq 0 iso 0 dist 7.30338 8.97414 9.99868 5.97401 5.21801 13.0272 numMergedOcc 0
11 mol 168 unq 1 iso 0 dist 7.30338 8.00063 3.5168 5.97401 5.21801 7.667 numMergedOcc 0
12 mol 171 unq 0 iso 0 dist 6.51523 7.06555 7.20382 12.1824 8.09699 13.1538 numMergedOcc 0
13 mol 184 unq 0 iso 0 dist 8.27396 9.10344 3.30691 11.2463 9.07247 11.6335 numMergedOcc 0
14 mol 186 unq 0 iso 0 dist 9.18289 6.99587 4.97041 13.4102 8.41456 12.0743 numMergedOcc 0
15 mol 186 unq 1 iso 0 dist 9.18289 4.37577 6.50779 13.4102 8.41456 13.1355 numMergedOcc 0
16 mol 205 unq 0 iso 0 dist 8.69512 5.66636 8.93955 7.43264 7.84418 11.5105 numMergedOcc 0
17 mol 205 unq 1 iso 0 dist 8.69512 5.66636 8.93955 12.1402 6.92823 14.3028 numMergedOcc 0
18 mol 222 unq 0 iso 0 dist 8.86886 4.90656 10.1968 6.45821 7.61739 9.95874 numMergedOcc 0
19 mol 283 unq 0 iso 0 dist 8.4275 9.35302 13.7144 7.50871 8.39635 16.6953 numMergedOcc 0
20 mol 283 unq 1 iso 0 dist 8.4275 8.85163 3.12129 7.50871 8.39635 9.33601 numMergedOcc 0
21 mol 285 unq 0 iso 0 dist 8.27917 6.73396 3.14843 10.8233 9.26793 8.38399 numMergedOcc 0
