0 mol 33 unq 0 iso 0 dist 9.06004 9.34266 4.43305 6.82054 4.78873 8.03913 numMergedOcc 0
1 mol 34 unq 0 iso 0 dist 8.6127 9.25005 4.74094 9.16728 6.38866 10.7075 numMergedOcc 0
2 mol 34 unq 1 iso 0 dist 9.25005 8.6127 4.74094 10.7132 9.48125 11.9917 numMergedOcc 0
3 mol 46 unq 0 iso 0 dist 5.92771 9.942 14.4922 4.38299 3.77542 13.7135 numMergedOcc 0
4 mol 83 unq 0 iso 0 dist 6.72584 7.25594 5.72008 11.4698 7.50925 11.9491 numMergedOcc 0
5 mol 83 unq 1 iso 0 dist 6.72584 7.25594 5.72008 10.6239 6.96722 7.61085 numMergedOcc 0
6 mol 83 unq 2 iso 0 dist 7.25594 6.72584 5.72008 10.6239 7.61085 6.96722 numMergedOcc 0
7 mol 123 unq 0 iso 0 dist 5.80266 8.09329 9.29446 7.36026 5.36214 10.7894 numMergedOcc 0
8 mol 123 unq 1 iso 0 dist 5.18305 6.13025 7.48549 6.45068 5.56127 10.7894 numMergedOcc 0
9 mol 123 unq 2 iso 0 dist 5.18305 6.78431 8.29136 6.45068 5.56127 5.36214 numMergedOcc 0
10 mol 123 unq 3 iso 0 dist 6.78431 5.18305 8.29136 6.45068 5.36214 5.56127 numMergedOcc 0
11 mol 123 unq 4 iso 0 dist 6.78431 6.13025 9.29446 6.45068 5.36214 10.7894 numMergedOcc 0
12 mol 143 unq 0 iso 0 dist 8.72521 8.19373 13.9042 10.1404 4.3855 16.8451 numMergedOcc 0
13 mol 158 unq 0 iso 0 dist 4.80508 4.88625 3.19759 5.73092 7.97228 9.28869 numMergedOcc 0
14 mol 168 unq 0 iso 0 dist 6.24232 6.13116 5.29906 8.3462 5.86767 10.293 numMergedOcc 0
15 mol 168 unq 1 iso 0 dist 6.24232 6.13116 5.29906 10.7396 5.28353 10.3204 numMergedOcc 0
16 mol 168 unq 2 iso 0 dist 8.1953 8.16253 5.29906 13.7178 5.86767 10.293 numMergedOcc 0
17 mol 168 unq 3 iso 0 dist 8.1953 8.16253 5.29906 9.33959 5.28353 10.3204 numMergedOcc 0
18 mol 169 unq 0 iso 0 dist 9.03941 8.69094 5.75027 9.52806 5.10589 8.28836 numMergedOcc 0
19 mol 184 unq 0 iso 0 dist 9.35481 9.11936 10.9743 10.2778 9.21536 16.5939 numMergedOcc 0
20 mol 184 unq 1 iso 0 dist 9.35481 8.20517 14.6266 10.2778 9.21536 18.388 numMergedOcc 0
21 mol 266 unq 0 iso 0 dist 9.02396 7.48115 3.00605 5.11028 7.8598 7.80711 numMergedOcc 0
22 mol 266 unq 1 iso 0 dist 9.02396 7.48115 3.00605 15.2885 8.25286 9.9965 numMergedOcc 0
23 mol 266 unq 2 iso 0 dist 7.48115 9.02396 3.00605 5.11028 7.80711 7.8598 numMergedOcc 0
24 mol 266 unq 3 iso 0 dist 7.48115 9.02396 3.00605 15.2885 9.9965 8.25286 numMergedOcc 0
25 mol 277 unq 0 iso 0 dist 9.00122 6.47907 3.75238 16.3502 7.98956 11.2004 numMergedOcc 0
26 mol 277 unq 1 iso 0 dist 9.00122 6.47907 3.75238 14.0447 5.86185 8.41856 numMergedOcc 0
27 mol 277 unq 2 iso 0 dist 9.00122 6.47907 3.75238 9.0121 6.79748 6.53598 numMergedOcc 0
28 mol 277 unq 3 iso 0 dist 6.47907 9.00122 3.75238 9.0121 6.53598 6.79748 numMergedOcc 0
29 mol 283 unq 0 iso 0 dist 8.3831 8.44179 5.13178 5.93642 7.31132 10.5454 numMergedOcc 0
