0 mol 5 unq 0 iso 0 dist 6.84403 12.3662 9.45559 9.86592 7.74636 9.59917 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 9.76233 7.08799 9.74528 7.86632 9.89425 11.3059 numMergedOcc 0
2 mol 29 unq 0 iso 0 dist 8.00338 4.80937 6.80828 9.70457 5.99655 5.45544 numMergedOcc 0
3 mol 32 unq 0 iso 0 dist 7.52145 14.6586 8.70331 12.2822 8.78511 4.87576 numMergedOcc 0
4 mol 32 unq 1 iso 0 dist 8.35776 5.87258 8.70331 4.64437 8.78511 4.87576 numMergedOcc 0
5 mol 76 unq 0 iso 0 dist 5.61831 8.53213 5.91098 6.2597 9.57759 13.363 numMergedOcc 0
6 mol 76 unq 1 iso 0 dist 5.61831 5.28721 4.86523 6.2597 9.57759 7.37421 numMergedOcc 0
7 mol 83 unq 0 iso 0 dist 9.75749 10.8383 7.69755 6.36916 5.35861 4.93836 numMergedOcc 0
8 mol 83 unq 1 iso 0 dist 9.75749 13.8436 9.64197 6.36916 5.35861 8.82563 numMergedOcc 0
9 mol 85 unq 0 iso 0 dist 7.61514 5.55433 7.51319 10.6609 4.29937 8.08787 numMergedOcc 0
10 mol 85 unq 1 iso 0 dist 7.61514 5.55433 7.51319 11.2518 3.65628 10.4844 numMergedOcc 0
11 mol 85 unq 2 iso 0 dist 7.61514 5.55433 7.51319 13.5746 9.77774 16.4231 numMergedOcc 0
12 mol 85 unq 3 iso 0 dist 7.61514 15.3673 9.43839 10.6609 4.29937 11.053 numMergedOcc 0
13 mol 85 unq 4 iso 0 dist 7.61514 15.3673 9.43839 11.2518 3.65628 7.97629 numMergedOcc 0
14 mol 85 unq 5 iso 0 dist 7.61514 15.3673 9.43839 13.5746 9.77774 5.46713 numMergedOcc 0
15 mol 85 unq 6 iso 0 dist 8.21116 15.6112 8.66427 10.6609 5.37869 12.4236 numMergedOcc 0
16 mol 85 unq 7 iso 0 dist 8.21116 15.6112 8.66427 11.2518 4.05415 9.61831 numMergedOcc 0
17 mol 85 unq 8 iso 0 dist 8.21116 15.6112 8.66427 13.5746 9.97944 11.3963 numMergedOcc 0
18 mol 85 unq 9 iso 0 dist 8.21116 5.55433 8.49887 10.6609 5.37869 8.08787 numMergedOcc 0
19 mol 85 unq 10 iso 0 dist 8.21116 5.55433 8.49887 11.2518 4.05415 10.4844 numMergedOcc 0
20 mol 85 unq 11 iso 0 dist 8.21116 5.55433 8.49887 13.5746 9.97944 16.4231 numMergedOcc 0
21 mol 107 unq 0 iso 0 dist 4.99934 11.7698 7.2168 4.05182 5.31375 9.89064 numMergedOcc 0
22 mol 107 unq 1 iso 0 dist 4.99934 11.7698 7.2168 4.11617 6.49371 13.076 numMergedOcc 0
23 mol 143 unq 0 iso 0 dist 6.91039 15.9297 9.99012 9.37902 6.60366 12.1494 numMergedOcc 0
24 mol 143 unq 1 iso 0 dist 6.91039 4.14823 5.33772 9.37902 6.60366 7.11802 numMergedOcc 0
25 mol 186 unq 0 iso 0 dist 8.19926 8.15466 4.79423 14.4294 8.92135 9.5548 numMergedOcc 0
26 mol 194 unq 0 iso 0 dist 9.3032 11.9253 7.56217 10.739 4.45769 5.39223 numMergedOcc 0
27 mol 194 unq 1 iso 0 dist 9.3032 11.9253 7.56217 16.8793 8.99961 7.15294 numMergedOcc 0
28 mol 194 unq 2 iso 0 dist 8.10451 9.14049 7.56217 5.22745 4.45769 5.39223 numMergedOcc 0
29 mol 194 unq 3 iso 0 dist 8.10451 9.14049 7.56217 4.77336 8.99961 7.15294 numMergedOcc 0
30 mol 194 unq 4 iso 0 dist 6.6747 9.14049 9.81055 5.22745 5.89939 5.39223 numMergedOcc 0
31 mol 194 unq 5 iso 0 dist 6.6747 9.14049 9.81055 4.77336 8.18853 7.15294 numMergedOcc 0
32 mol 194 unq 6 iso 0 dist 6.28412 15.4443 9.81055 12.1687 5.89939 5.39223 numMergedOcc 0
33 mol 194 unq 7 iso 0 dist 6.28412 15.4443 9.81055 13.0722 8.18853 7.15294 numMergedOcc 0
34 mol 252 unq 0 iso 0 dist 4.15692 10.2256 9.09279 8.3996 9.81261 15.5357 numMergedOcc 0
