0 mol 1 unq 0 iso 0 dist 9.78935 10.8375 8.56884 10.0773 8.78328 6.09918 numMergedOcc 0
1 mol 8 unq 0 iso 0 dist 5.46588 5.95251 8.99126 8.4444 6.69972 7.8922 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 5.36258 6.57145 8.23643 8.63204 6.87842 6.92532 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 5.36258 6.01189 8.73972 8.63204 6.87842 6.36455 numMergedOcc 0
4 mol 25 unq 0 iso 0 dist 5.88852 5.78908 7.685 9.99134 9.96732 5.81959 numMergedOcc 0
5 mol 92 unq 0 iso 0 dist 6.00131 6.09495 8.36431 11.0243 10.4141 6.61823 numMergedOcc 0
6 mol 92 unq 1 iso 0 dist 6.00131 6.09495 8.36431 5.22996 4.36639 6.49956 numMergedOcc 0
7 mol 100 unq 0 iso 0 dist 6.0026 6.89762 8.72704 14.5893 14.6145 9.00544 numMergedOcc 0
8 mol 100 unq 1 iso 0 dist 6.0026 6.89762 8.72704 6.14415 6.00843 7.12017 numMergedOcc 0
9 mol 183 unq 0 iso 0 dist 8.57818 5.72 7.01383 6.40448 5.45974 8.54827 numMergedOcc 0
10 mol 194 unq 0 iso 0 dist 8.40972 5.55582 6.15769 12.8922 13.9521 8.83356 numMergedOcc 0
11 mol 194 unq 1 iso 0 dist 7.03163 6.12629 6.15769 14.1566 13.9521 8.83356 numMergedOcc 0
12 mol 204 unq 0 iso 0 dist 9.01377 14.7256 9.59333 15.0065 10.3763 8.0144 numMergedOcc 0
13 mol 220 unq 0 iso 0 dist 5.00266 6.19375 6.99002 10.3653 11.2241 5.45036 numMergedOcc 0
14 mol 220 unq 1 iso 0 dist 5.00266 6.19375 6.99002 13.4973 9.68359 9.97586 numMergedOcc 0
15 mol 227 unq 0 iso 0 dist 6.37369 10.8811 9.62609 9.33735 5.23507 5.4694 numMergedOcc 0
16 mol 236 unq 0 iso 0 dist 5.77356 7.77821 5.34718 15.1409 11.6774 8.50331 numMergedOcc 0
17 mol 238 unq 0 iso 0 dist 7.87164 14.8949 9.68513 13.1395 6.48619 6.4398 numMergedOcc 0
18 mol 238 unq 1 iso 0 dist 7.87164 11.2453 9.29858 13.1395 6.48619 7.32982 numMergedOcc 0
19 mol 266 unq 0 iso 0 dist 5.45375 6.01492 9.02188 9.98606 8.12927 7.71657 numMergedOcc 0
