0 mol 20 unq 0 iso 0 dist 7.81533 8.91975 4.19193 9.63181 6.70835 10.5266 numMergedOcc 0
1 mol 27 unq 0 iso 0 dist 7.72334 6.68662 3.71141 5.80623 7.47886 5.92112 numMergedOcc 0
2 mol 27 unq 1 iso 0 dist 7.90154 9.11084 3.71141 6.75307 4.73598 6.50158 numMergedOcc 0
3 mol 27 unq 2 iso 0 dist 7.90154 9.11084 3.71141 7.24775 7.47886 5.92112 numMergedOcc 0
4 mol 120 unq 0 iso 0 dist 8.16773 5.71964 4.07626 8.41086 4.51697 6.93115 numMergedOcc 0
5 mol 120 unq 1 iso 0 dist 8.16773 6.82156 6.89429 8.41086 4.51697 10.3855 numMergedOcc 0
6 mol 123 unq 0 iso 0 dist 9.07528 8.57379 3.6989 5.98187 8.66026 6.6925 numMergedOcc 0
7 mol 123 unq 1 iso 0 dist 6.0636 5.87154 4.86856 7.42186 12.0907 11.9106 numMergedOcc 0
8 mol 123 unq 2 iso 0 dist 6.0636 6.82663 9.86125 7.42186 12.0907 6.6925 numMergedOcc 0
9 mol 123 unq 3 iso 0 dist 6.24626 5.87154 5.14679 7.42186 8.66026 11.9106 numMergedOcc 0
10 mol 123 unq 4 iso 0 dist 6.24626 6.82663 3.6989 7.42186 8.66026 6.6925 numMergedOcc 0
11 mol 136 unq 0 iso 0 dist 6.60605 9.12669 8.02079 9.2211 7.6418 12.7228 numMergedOcc 0
12 mol 148 unq 0 iso 0 dist 9.69869 9.62458 18.4303 9.92375 11.3546 14.4323 numMergedOcc 0
13 mol 148 unq 1 iso 0 dist 4.7785 9.62458 12.0468 9.92375 7.81802 14.4323 numMergedOcc 0
14 mol 184 unq 0 iso 0 dist 6.76009 7.79858 6.85777 5.92785 7.43402 9.96392 numMergedOcc 0
15 mol 184 unq 1 iso 0 dist 6.76009 7.19946 4.05105 5.92785 7.43402 5.65874 numMergedOcc 0
16 mol 192 unq 0 iso 0 dist 8.15486 6.08455 7.31685 7.27051 8.38671 7.52403 numMergedOcc 0
17 mol 192 unq 1 iso 0 dist 8.15486 6.08455 7.31685 7.35424 11.0721 6.91699 numMergedOcc 0
18 mol 250 unq 0 iso 0 dist 8.4419 9.86436 7.14732 9.5174 4.45194 11.4565 numMergedOcc 0
19 mol 256 unq 0 iso 0 dist 7.54244 8.94412 6.03934 5.17332 10.4051 10.2209 numMergedOcc 0
20 mol 260 unq 0 iso 0 dist 6.57783 8.67447 13.3882 6.8795 6.93995 10.9471 numMergedOcc 0
21 mol 260 unq 1 iso 0 dist 6.18853 8.67447 13.8125 6.8795 5.41537 10.9471 numMergedOcc 0
22 mol 260 unq 2 iso 0 dist 9.39891 8.67447 6.28373 6.8795 9.46946 10.9471 numMergedOcc 0
23 mol 272 unq 0 iso 0 dist 5.84116 5.75554 4.86323 8.16917 5.42668 8.47076 numMergedOcc 0
24 mol 287 unq 0 iso 0 dist 7.59237 7.17626 6.53691 8.82948 4.481 5.41757 numMergedOcc 0
25 mol 288 unq 0 iso 0 dist 7.59237 7.17626 6.53691 8.82948 4.481 5.41757 numMergedOcc 0
26 mol 289 unq 0 iso 0 dist 7.59237 7.17626 6.53691 8.82948 4.481 5.41757 numMergedOcc 0
