0 mol 9 unq 0 iso 0 dist 9.3793 7.25179 5.53103 7.95202 5.99562 4.61049 numMergedOcc 0
1 mol 9 unq 1 iso 0 dist 9.3793 7.25179 5.53103 6.75249 4.11085 6.64015 numMergedOcc 0
2 mol 18 unq 0 iso 0 dist 8.2056 6.41856 7.37821 5.03976 4.49033 5.01478 numMergedOcc 0
3 mol 18 unq 1 iso 0 dist 8.2056 8.51213 4.25207 5.03976 4.49033 7.04695 numMergedOcc 0
4 mol 26 unq 0 iso 0 dist 6.42206 7.34549 5.3315 9.08976 6.66387 11.887 numMergedOcc 0
5 mol 79 unq 0 iso 0 dist 9.04935 7.79726 12.1055 7.93317 9.59811 11.5972 numMergedOcc 0
6 mol 79 unq 1 iso 0 dist 9.04935 7.79726 12.1055 7.11013 11.9573 5.59971 numMergedOcc 0
7 mol 79 unq 2 iso 0 dist 9.04935 7.79726 12.1055 9.62096 13.9374 14.4245 numMergedOcc 0
8 mol 90 unq 0 iso 0 dist 4.90079 6.31203 4.8042 9.25984 5.51994 4.88519 numMergedOcc 0
9 mol 93 unq 0 iso 0 dist 8.84466 9.10877 12.5871 5.77804 12.5605 5.33106 numMergedOcc 0
10 mol 93 unq 1 iso 0 dist 9.2948 9.10877 13.6269 5.77804 10.878 5.33106 numMergedOcc 0
11 mol 110 unq 0 iso 0 dist 8.36172 7.2461 6.16247 9.58164 10.3999 10.9266 numMergedOcc 0
12 mol 110 unq 1 iso 0 dist 8.36172 9.26333 5.92996 9.58164 10.3999 7.85178 numMergedOcc 0
13 mol 115 unq 0 iso 0 dist 8.21127 5.11612 6.75472 9.36283 12.8154 6.34759 numMergedOcc 0
14 mol 146 unq 0 iso 0 dist 5.3184 8.53451 4.78114 6.66451 10.2064 13.71 numMergedOcc 0
15 mol 146 unq 1 iso 0 dist 5.3184 7.24965 5.44003 6.66451 10.2064 9.18212 numMergedOcc 0
16 mol 147 unq 0 iso 0 dist 5.70772 9.23551 10.5583 7.9061 4.10092 8.59354 numMergedOcc 0
17 mol 147 unq 1 iso 0 dist 5.70772 9.23551 10.5583 4.48898 4.47436 8.54341 numMergedOcc 0
18 mol 147 unq 2 iso 0 dist 8.93916 7.4653 8.95179 7.6489 4.10092 5.08802 numMergedOcc 0
19 mol 147 unq 3 iso 0 dist 8.93916 7.95564 11.4531 7.6489 4.10092 8.54445 numMergedOcc 0
20 mol 152 unq 0 iso 0 dist 8.30966 9.37459 14.6591 9.65224 13.0391 9.73393 numMergedOcc 0
21 mol 152 unq 1 iso 0 dist 8.30966 9.0847 12.2051 9.65224 13.0391 12.8308 numMergedOcc 0
22 mol 152 unq 2 iso 0 dist 8.30966 6.00061 9.67332 9.65224 13.0391 6.56944 numMergedOcc 0
23 mol 152 unq 3 iso 0 dist 8.30966 8.33302 6.18791 9.65224 13.0391 8.08549 numMergedOcc 0
24 mol 181 unq 0 iso 0 dist 8.94464 9.50454 9.32503 7.82604 6.39513 8.93318 numMergedOcc 0
25 mol 181 unq 1 iso 0 dist 8.94464 9.50454 9.32503 8.22583 6.24616 9.60512 numMergedOcc 0
26 mol 181 unq 2 iso 0 dist 8.94464 7.15963 13.2985 7.82604 6.39513 8.25067 numMergedOcc 0
27 mol 181 unq 3 iso 0 dist 8.94464 7.15963 13.2985 8.22583 6.24616 14.8479 numMergedOcc 0
28 mol 181 unq 4 iso 0 dist 8.63713 9.50454 8.88398 7.82604 5.70246 8.93318 numMergedOcc 0
29 mol 181 unq 5 iso 0 dist 8.63713 9.50454 8.88398 8.22583 14.1913 9.60512 numMergedOcc 0
30 mol 181 unq 6 iso 0 dist 8.63713 7.15963 4.98009 7.82604 5.70246 8.25067 numMergedOcc 0
31 mol 181 unq 7 iso 0 dist 8.63713 7.15963 4.98009 8.22583 14.1913 14.8479 numMergedOcc 0
32 mol 196 unq 0 iso 0 dist 5.76319 7.84536 4.57882 7.85296 4.55808 8.91474 numMergedOcc 0
33 mol 196 unq 1 iso 0 dist 5.30132 7.07723 4.57882 8.2841 4.55808 8.91474 numMergedOcc 0
34 mol 196 unq 2 iso 0 dist 8.36119 8.69629 6.70722 8.2424 4.55808 7.02839 numMergedOcc 0
35 mol 259 unq 0 iso 0 dist 6.83706 8.69345 10.7398 5.68415 7.53102 5.20486 numMergedOcc 0
36 mol 265 unq 0 iso 0 dist 8.09021 6.78702 5.75478 7.74463 5.55314 6.43013 numMergedOcc 0
37 mol 265 unq 1 iso 0 dist 6.98451 8.59825 5.75478 5.88787 6.97049 5.51535 numMergedOcc 0
38 mol 265 unq 2 iso 0 dist 6.98451 7.83102 9.74462 5.88787 6.97049 4.65134 numMergedOcc 0
39 mol 267 unq 0 iso 0 dist 9.60447 6.19138 10.2663 9.18446 13.3347 6.45566 numMergedOcc 0
