0 mol 5 unq 0 iso 0 dist 9.8143 6.89121 8.81964 10.0207 4.66108 7.24457 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 9.36538 9.14826 5.41248 11.8091 7.36147 4.92734 numMergedOcc 0
2 mol 8 unq 1 iso 0 dist 9.36538 9.14826 5.41248 14.8677 7.04632 6.26138 numMergedOcc 0
3 mol 8 unq 2 iso 0 dist 9.36538 9.14826 5.41248 15.3703 10.1093 6.57999 numMergedOcc 0
4 mol 56 unq 0 iso 0 dist 8.34435 9.42688 4.80247 10.7264 10.6193 9.77018 numMergedOcc 0
5 mol 73 unq 0 iso 0 dist 8.50028 12.1332 6.85356 19.1069 11.6012 8.16299 numMergedOcc 0
6 mol 86 unq 0 iso 0 dist 8.8236 5.80063 9.67574 5.49793 7.89966 8.40609 numMergedOcc 0
7 mol 114 unq 0 iso 0 dist 7.35639 6.15538 6.67941 10.2548 4.26125 7.23973 numMergedOcc 0
8 mol 131 unq 0 iso 0 dist 8.98949 5.7687 6.45169 6.38977 7.47571 9.33945 numMergedOcc 0
9 mol 134 unq 0 iso 0 dist 9.67331 3.94348 6.00896 10.3211 4.8408 6.54987 numMergedOcc 0
10 mol 158 unq 0 iso 0 dist 7.75233 5.784 9.08686 9.88262 8.98359 8.59098 numMergedOcc 0
11 mol 172 unq 0 iso 0 dist 8.26094 10.209 7.77643 14.6642 8.10512 7.34586 numMergedOcc 0
12 mol 172 unq 1 iso 0 dist 8.26094 11.546 4.90175 18.3471 10.6482 9.54849 numMergedOcc 0
13 mol 172 unq 2 iso 0 dist 8.26094 11.546 4.90175 14.6642 8.10512 5.5139 numMergedOcc 0
14 mol 238 unq 0 iso 0 dist 8.66923 10.2699 7.75366 14.7634 10.3683 4.87108 numMergedOcc 0
15 mol 238 unq 1 iso 0 dist 8.66923 10.2699 7.75366 14.66 10.313 7.64276 numMergedOcc 0
16 mol 277 unq 0 iso 0 dist 7.35191 8.05625 6.40125 14.0664 12.8864 7.07459 numMergedOcc 0
17 mol 277 unq 1 iso 0 dist 7.35191 5.99494 7.25282 12.7029 8.31543 8.82899 numMergedOcc 0
