0 mol 26 unq 0 iso 0 dist 8.42581 6.15893 8.95026 7.97596 13.5481 9.82851 numMergedOcc 0
1 mol 26 unq 1 iso 0 dist 8.42581 5.497 5.45023 7.97596 13.5481 9.11311 numMergedOcc 0
2 mol 39 unq 0 iso 0 dist 8.19733 6.24515 5.14532 8.56189 5.00813 9.02925 numMergedOcc 0
3 mol 39 unq 1 iso 0 dist 8.57165 9.48031 5.93538 7.29013 5.00813 9.76979 numMergedOcc 0
4 mol 58 unq 0 iso 0 dist 7.93481 9.11258 13.9844 4.43437 11.3972 6.41008 numMergedOcc 0
5 mol 62 unq 0 iso 0 dist 9.87677 6.04903 7.97193 5.27573 9.71949 8.21895 numMergedOcc 0
6 mol 119 unq 0 iso 0 dist 9.05798 7.26955 7.34151 3.71283 8.34342 6.21165 numMergedOcc 0
7 mol 119 unq 1 iso 0 dist 5.85818 7.26955 11.7884 3.71283 7.62197 6.21165 numMergedOcc 0
8 mol 128 unq 0 iso 0 dist 9.89462 6.98158 4.68499 10.624 10.4219 7.4442 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 8.77898 6.21403 13.5292 5.45 13.8093 5.13405 numMergedOcc 0
10 mol 143 unq 0 iso 0 dist 6.40901 9.30424 5.99865 4.19541 7.22 7.2932 numMergedOcc 0
11 mol 143 unq 1 iso 0 dist 9.40626 9.30424 11.2236 4.19541 12.0797 7.2932 numMergedOcc 0
12 mol 146 unq 0 iso 0 dist 8.68349 6.50043 7.20408 6.19717 8.71836 6.73137 numMergedOcc 0
13 mol 146 unq 1 iso 0 dist 8.68349 9.44952 6.00811 6.19717 8.71836 5.95148 numMergedOcc 0
14 mol 148 unq 0 iso 0 dist 8.12589 8.73468 7.23332 10.8312 12.1586 9.17462 numMergedOcc 0
15 mol 148 unq 1 iso 0 dist 8.12589 8.73468 7.23332 4.43652 11.3234 8.74878 numMergedOcc 0
16 mol 148 unq 2 iso 0 dist 8.12589 9.73927 7.89336 10.8312 12.1586 5.75959 numMergedOcc 0
17 mol 150 unq 0 iso 0 dist 8.11592 8.73558 7.35366 10.8596 12.0071 9.01668 numMergedOcc 0
18 mol 150 unq 1 iso 0 dist 8.11592 8.73558 7.35366 4.48089 11.3798 8.74018 numMergedOcc 0
19 mol 150 unq 2 iso 0 dist 8.11592 9.66129 7.86976 10.8596 12.0071 5.4798 numMergedOcc 0
20 mol 158 unq 0 iso 0 dist 6.39981 9.6096 10.3886 5.30823 8.06621 4.6512 numMergedOcc 0
21 mol 188 unq 0 iso 0 dist 7.48284 9.33696 5.87427 4.61059 6.18257 8.4784 numMergedOcc 0
22 mol 214 unq 0 iso 0 dist 7.39624 7.69296 4.23527 3.92649 6.20118 5.05626 numMergedOcc 0
23 mol 214 unq 1 iso 0 dist 7.39624 7.69296 4.23527 11.4548 11.5842 8.41013 numMergedOcc 0
24 mol 277 unq 0 iso 0 dist 7.25677 6.43034 5.43373 6.50127 8.78893 6.23115 numMergedOcc 0
25 mol 277 unq 1 iso 0 dist 6.73126 6.43034 7.17477 6.50127 4.61089 6.23115 numMergedOcc 0
