0 mol 24 unq 0 iso 0 dist 9.49404 14.0001 8.83657 6.23313 8.85286 9.78196 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 9.49404 10.5205 6.74914 6.23313 8.85286 8.20543 numMergedOcc 0
2 mol 34 unq 0 iso 0 dist 8.87762 7.4142 7.93454 4.96658 9.41098 3.63648 numMergedOcc 0
3 mol 62 unq 0 iso 0 dist 5.48283 7.41234 9.51893 5.4275 7.16844 10.4041 numMergedOcc 0
4 mol 62 unq 1 iso 0 dist 5.48283 4.38006 8.09973 5.4275 7.16844 3.66673 numMergedOcc 0
5 mol 67 unq 0 iso 0 dist 5.35145 5.01328 6.89527 5.88789 5.88409 7.68524 numMergedOcc 0
6 mol 76 unq 0 iso 0 dist 5.65006 4.63832 8.25047 5.5308 5.45099 8.58059 numMergedOcc 0
7 mol 76 unq 1 iso 0 dist 5.65006 4.63832 8.25047 10.5881 8.44765 14.7497 numMergedOcc 0
8 mol 76 unq 2 iso 0 dist 5.65006 4.63832 8.25047 9.74852 9.06643 14.3572 numMergedOcc 0
9 mol 79 unq 0 iso 0 dist 8.17687 5.60895 7.65917 3.37256 9.54696 3.87187 numMergedOcc 0
10 mol 79 unq 1 iso 0 dist 8.17687 5.60895 7.65917 6.27386 4.62636 7.45894 numMergedOcc 0
11 mol 91 unq 0 iso 0 dist 9.27894 8.32183 6.64714 10.358 7.71625 9.46631 numMergedOcc 0
12 mol 107 unq 0 iso 0 dist 8.2411 12.2324 8.50257 10.9097 7.91251 3.51814 numMergedOcc 0
13 mol 107 unq 1 iso 0 dist 8.2411 12.2324 8.50257 4.34186 9.09262 13.9569 numMergedOcc 0
14 mol 141 unq 0 iso 0 dist 6.31404 7.37698 5.24228 10.2525 5.95801 6.46148 numMergedOcc 0
15 mol 141 unq 1 iso 0 dist 6.31404 7.37698 5.24228 14.7938 9.92715 14.5965 numMergedOcc 0
16 mol 186 unq 0 iso 0 dist 7.44523 14.0181 9.22792 6.14958 6.94594 10.2655 numMergedOcc 0
17 mol 186 unq 1 iso 0 dist 7.44523 14.0181 9.22792 5.87342 5.81881 11.6331 numMergedOcc 0
18 mol 225 unq 0 iso 0 dist 6.20862 5.47022 7.9002 13.4094 8.74463 13.7057 numMergedOcc 0
19 mol 225 unq 1 iso 0 dist 7.27888 11.9667 7.9002 6.04835 8.74463 13.7057 numMergedOcc 0
20 mol 233 unq 0 iso 0 dist 7.79426 5.09438 9.79864 10.3577 8.4338 13.1316 numMergedOcc 0
21 mol 243 unq 0 iso 0 dist 7.42359 6.96883 8.8602 6.56644 9.53137 12.159 numMergedOcc 0
22 mol 243 unq 1 iso 0 dist 7.42359 5.23854 7.13476 6.56644 9.53137 5.38511 numMergedOcc 0
23 mol 243 unq 2 iso 0 dist 7.42359 13.6058 9.49016 6.56644 9.53137 18.1416 numMergedOcc 0
24 mol 279 unq 0 iso 0 dist 7.75982 5.65689 8.88095 3.72284 8.62266 6.15282 numMergedOcc 0
25 mol 279 unq 1 iso 0 dist 6.66483 6.52322 8.22717 8.07304 7.90632 5.61835 numMergedOcc 0
26 mol 279 unq 2 iso 0 dist 6.66483 11.2974 8.43409 8.07304 7.90632 11.2075 numMergedOcc 0
27 mol 279 unq 3 iso 0 dist 5.52111 4.84534 8.22717 7.39007 7.90632 5.61835 numMergedOcc 0
28 mol 279 unq 4 iso 0 dist 5.52111 4.0763 8.43409 7.39007 7.90632 11.2075 numMergedOcc 0
29 mol 287 unq 0 iso 0 dist 7.37164 5.22713 7.51385 7.52677 6.22311 6.00938 numMergedOcc 0
30 mol 288 unq 0 iso 0 dist 7.37164 5.22713 7.51385 7.52677 6.22311 6.00938 numMergedOcc 0
31 mol 289 unq 0 iso 0 dist 7.37164 5.22713 7.51385 7.52677 6.22311 6.00938 numMergedOcc 0
32 mol 292 unq 0 iso 0 dist 8.51266 7.39939 9.18386 5.92057 9.56933 9.45033 numMergedOcc 0
