0 mol 33 unq 0 iso 0 dist 5.65377 9.06004 3.82411 6.82054 4.41045 4.78873 numMergedOcc 0
1 mol 33 unq 1 iso 0 dist 5.65377 9.34266 4.28598 6.82054 4.41045 8.03913 numMergedOcc 0
2 mol 46 unq 0 iso 0 dist 6.47185 9.942 15.3318 4.38299 5.81662 13.7135 numMergedOcc 0
3 mol 46 unq 1 iso 0 dist 6.47185 5.92771 3.8412 4.38299 5.81662 3.77542 numMergedOcc 0
4 mol 62 unq 0 iso 0 dist 9.09269 6.42645 3.70802 7.49995 7.49792 4.46067 numMergedOcc 0
5 mol 69 unq 0 iso 0 dist 8.61203 7.07055 7.7289 8.0664 7.31881 12.4019 numMergedOcc 0
6 mol 91 unq 0 iso 0 dist 9.19143 8.66819 9.46631 9.65792 7.09177 14.8326 numMergedOcc 0
7 mol 91 unq 1 iso 0 dist 9.23907 8.47126 9.46631 11.3286 7.09177 14.8326 numMergedOcc 0
8 mol 96 unq 0 iso 0 dist 8.94847 8.9912 9.31814 6.61175 7.22615 12.3932 numMergedOcc 0
9 mol 176 unq 0 iso 0 dist 9.56967 6.95058 3.75017 5.37694 9.40603 8.65645 numMergedOcc 0
10 mol 176 unq 1 iso 0 dist 7.66242 6.95058 3.84631 4.99447 8.00223 6.85902 numMergedOcc 0
11 mol 176 unq 2 iso 0 dist 7.66242 6.95058 3.84631 5.46526 9.60695 10.081 numMergedOcc 0
12 mol 182 unq 0 iso 0 dist 6.06892 7.01577 7.7167 8.98721 8.54982 13.1677 numMergedOcc 0
13 mol 204 unq 0 iso 0 dist 7.79856 7.00278 6.82158 7.89584 9.60981 13.4407 numMergedOcc 0
14 mol 204 unq 1 iso 0 dist 7.79856 7.00278 6.82158 6.46602 7.15344 8.32259 numMergedOcc 0
15 mol 204 unq 2 iso 0 dist 7.79856 7.00278 6.82158 8.23616 9.98617 9.93489 numMergedOcc 0
16 mol 218 unq 0 iso 0 dist 6.43416 8.5458 9.83826 8.95992 9.08818 15.6688 numMergedOcc 0
17 mol 218 unq 1 iso 0 dist 6.43416 8.5458 9.83826 10.3622 8.5163 17.518 numMergedOcc 0
18 mol 257 unq 0 iso 0 dist 5.50393 8.18447 7.65595 14.053 9.79593 16.2037 numMergedOcc 0
19 mol 283 unq 0 iso 0 dist 9.72248 8.3831 6.30031 5.93642 7.17276 7.31132 numMergedOcc 0
20 mol 283 unq 1 iso 0 dist 9.72248 8.44179 8.78323 5.93642 7.17276 10.5454 numMergedOcc 0
21 mol 284 unq 0 iso 0 dist 7.41633 4.69611 5.88619 3.39008 5.2862 5.6964 numMergedOcc 0
22 mol 284 unq 1 iso 0 dist 5.52837 4.69611 4.57529 3.39008 5.31097 5.6964 numMergedOcc 0
23 mol 287 unq 0 iso 0 dist 6.81636 8.08382 11.4589 6.1158 8.4625 4.68668 numMergedOcc 0
24 mol 287 unq 1 iso 0 dist 7.80478 6.23874 3.76412 15.9206 8.15636 10.5724 numMergedOcc 0
25 mol 287 unq 2 iso 0 dist 7.80478 6.23874 3.76412 14.0034 7.86292 9.98932 numMergedOcc 0
26 mol 287 unq 3 iso 0 dist 7.80478 6.68956 5.39384 15.9206 8.15636 11.983 numMergedOcc 0
27 mol 287 unq 4 iso 0 dist 7.80478 6.68956 5.39384 14.0034 7.86292 13.1856 numMergedOcc 0
28 mol 288 unq 0 iso 0 dist 6.81636 8.08382 11.4589 6.1158 8.4625 4.68668 numMergedOcc 0
29 mol 288 unq 1 iso 0 dist 7.80478 6.23874 3.76412 15.9206 8.15636 10.5724 numMergedOcc 0
30 mol 288 unq 2 iso 0 dist 7.80478 6.23874 3.76412 14.0034 7.86292 9.98932 numMergedOcc 0
31 mol 288 unq 3 iso 0 dist 7.80478 6.68956 5.39384 15.9206 8.15636 11.983 numMergedOcc 0
32 mol 288 unq 4 iso 0 dist 7.80478 6.68956 5.39384 14.0034 7.86292 13.1856 numMergedOcc 0
33 mol 289 unq 0 iso 0 dist 6.81636 8.08382 11.4589 6.1158 8.4625 4.68668 numMergedOcc 0
34 mol 289 unq 1 iso 0 dist 7.80478 6.23874 3.76412 15.9206 8.15636 10.5724 numMergedOcc 0
35 mol 289 unq 2 iso 0 dist 7.80478 6.23874 3.76412 14.0034 7.86292 9.98932 numMergedOcc 0
36 mol 289 unq 3 iso 0 dist 7.80478 6.68956 5.39384 15.9206 8.15636 11.983 numMergedOcc 0
37 mol 289 unq 4 iso 0 dist 7.80478 6.68956 5.39384 14.0034 7.86292 13.1856 numMergedOcc 0
