0 mol 15 unq 0 iso 0 dist 9.20338 12.2224 8.96967 14.2985 5.51916 9.78051 numMergedOcc 0
1 mol 45 unq 0 iso 0 dist 6.94727 11.5096 8.13782 19.9215 16.2375 9.20119 numMergedOcc 0
2 mol 64 unq 0 iso 0 dist 9.14856 5.78769 8.4517 12.2258 5.35421 8.68586 numMergedOcc 0
3 mol 64 unq 1 iso 0 dist 9.14856 5.78769 8.4517 6.6003 5.68303 9.54144 numMergedOcc 0
4 mol 64 unq 2 iso 0 dist 4.97843 5.29079 8.06829 6.6003 4.94316 9.80142 numMergedOcc 0
5 mol 69 unq 0 iso 0 dist 7.78321 4.68683 9.70189 9.74996 11.1718 7.04352 numMergedOcc 0
6 mol 72 unq 0 iso 0 dist 6.13507 8.61357 8.59747 11.5751 7.17489 7.321 numMergedOcc 0
7 mol 99 unq 0 iso 0 dist 8.15733 5.17028 6.6925 11.5944 5.81128 7.72108 numMergedOcc 0
8 mol 127 unq 0 iso 0 dist 8.20636 13.4385 6.3244 22.1143 14.085 9.81878 numMergedOcc 0
9 mol 127 unq 1 iso 0 dist 8.03243 7.34983 6.3244 8.40046 14.085 9.81878 numMergedOcc 0
10 mol 140 unq 0 iso 0 dist 7.79467 5.36419 5.63811 11.7961 6.69673 6.95323 numMergedOcc 0
11 mol 140 unq 1 iso 0 dist 7.79467 5.36419 5.63811 9.93572 8.17877 7.27371 numMergedOcc 0
12 mol 155 unq 0 iso 0 dist 5.64806 5.84938 6.51096 9.70079 6.3845 9.17284 numMergedOcc 0
13 mol 155 unq 1 iso 0 dist 5.64806 5.84938 6.51096 9.83554 5.48883 9.87281 numMergedOcc 0
14 mol 155 unq 2 iso 0 dist 5.64806 5.84938 6.51096 7.02715 5.77564 8.87452 numMergedOcc 0
15 mol 155 unq 3 iso 0 dist 5.64806 9.52867 8.73171 9.83554 5.48883 8.27111 numMergedOcc 0
16 mol 155 unq 4 iso 0 dist 5.64806 9.52867 8.73171 7.02715 5.77564 7.68368 numMergedOcc 0
17 mol 156 unq 0 iso 0 dist 8.47477 5.74389 6.90155 13.7967 9.30783 8.47155 numMergedOcc 0
18 mol 156 unq 1 iso 0 dist 8.47477 5.74389 6.90155 12.8527 7.29758 9.36805 numMergedOcc 0
19 mol 156 unq 2 iso 0 dist 8.47477 5.74389 6.90155 11.0838 4.53931 7.55203 numMergedOcc 0
20 mol 156 unq 3 iso 0 dist 8.57453 4.95416 6.90155 12.7959 9.30783 8.47155 numMergedOcc 0
21 mol 156 unq 4 iso 0 dist 8.57453 4.95416 6.90155 13.6067 7.29758 9.36805 numMergedOcc 0
22 mol 156 unq 5 iso 0 dist 8.57453 4.95416 6.90155 9.16591 4.53931 7.55203 numMergedOcc 0
23 mol 175 unq 0 iso 0 dist 6.84347 8.65486 4.79852 17.1425 11.0415 9.8589 numMergedOcc 0
24 mol 175 unq 1 iso 0 dist 6.84347 8.65486 4.79852 11.1504 5.0384 7.24908 numMergedOcc 0
25 mol 224 unq 0 iso 0 dist 6.4508 11.498 9.47554 9.33771 5.29877 6.87664 numMergedOcc 0
26 mol 224 unq 1 iso 0 dist 8.60781 5.46434 8.89778 9.34636 7.98696 7.06793 numMergedOcc 0
27 mol 224 unq 2 iso 0 dist 8.60781 5.03449 9.47554 9.34636 7.98696 6.67585 numMergedOcc 0
28 mol 224 unq 3 iso 0 dist 8.60781 5.03449 9.47554 9.79616 7.12232 6.65984 numMergedOcc 0
29 mol 234 unq 0 iso 0 dist 8.79054 13.0843 9.6101 16.9568 12.1076 9.5707 numMergedOcc 0
30 mol 234 unq 1 iso 0 dist 8.79054 6.7061 5.32183 14.6848 6.29366 9.39181 numMergedOcc 0
31 mol 235 unq 0 iso 0 dist 7.29546 10.2924 7.27958 11.5033 10.6981 8.21247 numMergedOcc 0
32 mol 258 unq 0 iso 0 dist 9.09553 5.28906 7.16259 5.73296 5.95565 6.49982 numMergedOcc 0
33 mol 274 unq 0 iso 0 dist 8.33004 5.50007 8.49866 9.51651 5.31116 6.50589 numMergedOcc 0
34 mol 274 unq 1 iso 0 dist 5.42845 4.05661 8.49866 6.00877 5.31116 6.50589 numMergedOcc 0
35 mol 274 unq 2 iso 0 dist 5.62484 7.47324 8.49866 8.66451 5.31116 6.50589 numMergedOcc 0
36 mol 282 unq 0 iso 0 dist 9.79549 8.97979 6.73692 14.0198 5.9438 9.58517 numMergedOcc 0
37 mol 282 unq 1 iso 0 dist 9.69725 5.65144 6.73692 9.12049 5.9438 9.58517 numMergedOcc 0
38 mol 293 unq 0 iso 0 dist 7.96687 4.91842 6.33356 12.8923 8.15509 9.97212 numMergedOcc 0
39 mol 293 unq 1 iso 0 dist 9.37994 6.59783 6.33356 15.9392 8.15509 9.97212 numMergedOcc 0
40 mol 294 unq 0 iso 0 dist 8.72608 8.04679 7.72845 10.7808 6.46298 9.03492 numMergedOcc 0
