0 mol 8 unq 0 iso 0 dist 9.95422 6.92865 12.3778 8.95363 17.6784 7.8922 numMergedOcc 0
1 mol 8 unq 1 iso 0 dist 7.65219 6.92865 5.95251 8.95363 8.4444 7.8922 numMergedOcc 0
2 mol 19 unq 0 iso 0 dist 6.8824 7.84393 10.38 4.93362 9.23617 6.36455 numMergedOcc 0
3 mol 19 unq 1 iso 0 dist 8.33492 7.84393 6.01189 4.93362 8.63204 6.36455 numMergedOcc 0
4 mol 33 unq 0 iso 0 dist 7.99091 5.66319 5.62472 6.24385 5.2746 8.00177 numMergedOcc 0
5 mol 33 unq 1 iso 0 dist 9.82882 5.66319 6.77726 6.24385 12.0863 8.00177 numMergedOcc 0
6 mol 68 unq 0 iso 0 dist 6.85894 7.14865 7.02846 7.12794 12.5034 7.9814 numMergedOcc 0
7 mol 103 unq 0 iso 0 dist 5.24823 7.55805 5.54757 8.4354 11.9034 9.44561 numMergedOcc 0
8 mol 115 unq 0 iso 0 dist 9.36674 9.56867 16.6569 4.64486 13.5583 5.74857 numMergedOcc 0
9 mol 133 unq 0 iso 0 dist 8.08807 8.96061 12.058 5.94764 13.6546 8.56003 numMergedOcc 0
10 mol 134 unq 0 iso 0 dist 8.84695 7.97208 7.46245 11.5403 11.1254 5.53031 numMergedOcc 0
11 mol 143 unq 0 iso 0 dist 5.9183 7.5984 6.3915 11.1239 13.0547 8.41611 numMergedOcc 0
12 mol 143 unq 1 iso 0 dist 5.9183 7.5984 6.3915 14.3979 13.9236 7.63338 numMergedOcc 0
13 mol 143 unq 2 iso 0 dist 5.9183 7.5984 6.3915 9.05442 12.3804 9.03707 numMergedOcc 0
14 mol 143 unq 3 iso 0 dist 5.9183 7.5984 6.3915 12.1804 12.697 7.25673 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 7.29651 7.45401 12.5982 8.19136 15.2935 7.20574 numMergedOcc 0
16 mol 220 unq 0 iso 0 dist 8.37469 8.9077 16.7786 5.41948 13.4238 5.45036 numMergedOcc 0
17 mol 220 unq 1 iso 0 dist 8.37469 8.9077 16.7786 15.1445 20.8596 9.97586 numMergedOcc 0
18 mol 223 unq 0 iso 0 dist 9.03969 9.94212 10.6103 6.33419 10.2511 6.13306 numMergedOcc 0
19 mol 229 unq 0 iso 0 dist 5.22312 8.0007 6.44004 7.57247 9.3376 5.77318 numMergedOcc 0
20 mol 230 unq 0 iso 0 dist 9.26431 8.56954 5.56464 6.46721 9.81251 9.09271 numMergedOcc 0
21 mol 230 unq 1 iso 0 dist 9.26431 9.23938 10.1392 6.46721 9.81251 7.44838 numMergedOcc 0
22 mol 235 unq 0 iso 0 dist 8.67216 7.93727 6.25282 3.94313 10.6746 7.75722 numMergedOcc 0
23 mol 240 unq 0 iso 0 dist 6.87809 6.01168 6.24198 14.3522 13.9986 9.47583 numMergedOcc 0
24 mol 240 unq 1 iso 0 dist 6.87809 7.72928 5.90601 14.3522 13.9986 8.44909 numMergedOcc 0
25 mol 287 unq 0 iso 0 dist 8.59579 7.45019 10.7098 7.10281 15.2948 9.74402 numMergedOcc 0
26 mol 288 unq 0 iso 0 dist 8.59579 7.45019 10.7098 7.10281 15.2948 9.74402 numMergedOcc 0
27 mol 289 unq 0 iso 0 dist 8.59579 7.45019 10.7098 7.10281 15.2948 9.74402 numMergedOcc 0
