0 mol 24 unq 0 iso 0 dist 5.65754 5.61248 7.7447 8.3964 9.63925 5.80953 10.0962 8.25818 11.1587 7.85986 numMergedOcc 0
1 mol 24 unq 1 iso 0 dist 5.65754 5.61248 7.7447 8.3964 9.63925 5.80953 8.56474 10.2171 8.72577 4.30252 numMergedOcc 0
2 mol 79 unq 0 iso 0 dist 6.65972 11.5374 9.04293 9.21479 5.84075 9.77084 13.0624 12.5398 11.5615 7.56495 numMergedOcc 0
3 mol 79 unq 1 iso 0 dist 6.65972 11.5374 9.04293 9.21479 5.84075 9.77084 8.65653 10.5441 10.6375 7.63923 numMergedOcc 0
4 mol 79 unq 2 iso 0 dist 6.65972 11.5374 9.04293 9.21479 5.84075 9.77084 13.4886 10.8758 5.57609 8.23095 numMergedOcc 0
5 mol 79 unq 3 iso 0 dist 6.65972 5.21981 4.78333 9.21479 5.84075 6.5551 13.0624 12.5398 10.2908 7.56495 numMergedOcc 0
6 mol 79 unq 4 iso 0 dist 6.65972 5.21981 4.78333 9.21479 5.84075 6.5551 8.65653 10.5441 7.19532 7.63923 numMergedOcc 0
7 mol 79 unq 5 iso 0 dist 6.65972 5.21981 4.78333 9.21479 5.84075 6.5551 13.4886 10.8758 8.58888 8.23095 numMergedOcc 0
8 mol 79 unq 6 iso 0 dist 4.2253 5.21981 4.74254 9.21479 5.41884 6.5551 13.0624 9.56766 10.2908 7.56495 numMergedOcc 0
9 mol 79 unq 7 iso 0 dist 4.2253 5.21981 4.74254 9.21479 5.41884 6.5551 8.65653 6.20144 7.19532 7.63923 numMergedOcc 0
10 mol 79 unq 8 iso 0 dist 4.2253 5.21981 4.74254 9.21479 5.41884 6.5551 13.4886 11.082 8.58888 8.23095 numMergedOcc 0
11 mol 85 unq 0 iso 0 dist 8.66427 12.4236 5.37869 15.0808 7.66499 5.05893 13.8217 7.04244 3.65186 8.04853 numMergedOcc 0
12 mol 85 unq 1 iso 0 dist 8.66427 12.4236 5.37869 15.0808 7.66499 5.05893 14.23 9.59497 5.41777 6.46549 numMergedOcc 0
13 mol 85 unq 2 iso 0 dist 8.66427 9.61831 4.05415 15.0808 7.66499 5.71866 13.8217 7.04244 7.00044 8.04853 numMergedOcc 0
14 mol 85 unq 3 iso 0 dist 8.66427 9.61831 4.05415 15.0808 7.66499 5.71866 14.23 9.59497 5.85247 6.46549 numMergedOcc 0
15 mol 85 unq 4 iso 0 dist 7.51319 8.08787 4.29937 9.18097 5.22259 5.05893 6.90443 6.67137 3.65186 8.04853 numMergedOcc 0
16 mol 85 unq 5 iso 0 dist 7.51319 8.08787 4.29937 9.18097 5.22259 5.05893 13.1381 8.49871 5.41777 6.46549 numMergedOcc 0
17 mol 85 unq 6 iso 0 dist 7.51319 10.4844 3.65628 9.18097 5.22259 5.71866 6.90443 6.67137 7.00044 8.04853 numMergedOcc 0
18 mol 85 unq 7 iso 0 dist 7.51319 10.4844 3.65628 9.18097 5.22259 5.71866 13.1381 8.49871 5.85247 6.46549 numMergedOcc 0
19 mol 85 unq 8 iso 0 dist 8.49887 8.08787 5.37869 9.18097 7.66499 5.05893 6.90443 7.04244 3.65186 8.04853 numMergedOcc 0
20 mol 85 unq 9 iso 0 dist 8.49887 8.08787 5.37869 9.18097 7.66499 5.05893 13.1381 9.59497 5.41777 6.46549 numMergedOcc 0
21 mol 85 unq 10 iso 0 dist 8.49887 10.4844 4.05415 9.18097 7.66499 5.71866 6.90443 7.04244 7.00044 8.04853 numMergedOcc 0
22 mol 85 unq 11 iso 0 dist 8.49887 10.4844 4.05415 9.18097 7.66499 5.71866 13.1381 9.59497 5.85247 6.46549 numMergedOcc 0
23 mol 85 unq 12 iso 0 dist 9.43839 11.053 4.29937 8.83135 5.22259 5.05893 14.6513 6.67137 3.65186 8.04853 numMergedOcc 0
24 mol 85 unq 13 iso 0 dist 9.43839 11.053 4.29937 8.83135 5.22259 5.05893 9.99421 8.49871 5.41777 6.46549 numMergedOcc 0
25 mol 85 unq 14 iso 0 dist 9.43839 7.97629 3.65628 8.83135 5.22259 5.71866 14.6513 6.67137 7.00044 8.04853 numMergedOcc 0
26 mol 85 unq 15 iso 0 dist 9.43839 7.97629 3.65628 8.83135 5.22259 5.71866 9.99421 8.49871 5.85247 6.46549 numMergedOcc 0
27 mol 91 unq 0 iso 0 dist 8.91998 5.09341 7.71625 6.93893 12.8723 8.77355 12.7678 14.8326 9.60912 9.97813 numMergedOcc 0
28 mol 93 unq 0 iso 0 dist 8.55758 5.84807 6.67678 7.13064 5.64998 9.19977 9.6722 10.8976 13.1331 5.56839 numMergedOcc 0
29 mol 93 unq 1 iso 0 dist 8.55758 5.84807 6.67678 7.8962 4.34681 7.28831 9.6722 10.8976 13.1331 7.83506 numMergedOcc 0
30 mol 93 unq 2 iso 0 dist 7.44027 5.84807 7.24956 7.13064 4.76749 9.19977 9.6722 10.3155 13.1331 5.56839 numMergedOcc 0
31 mol 93 unq 3 iso 0 dist 7.44027 5.84807 7.24956 7.8962 5.73248 7.28831 9.6722 10.3155 13.1331 7.83506 numMergedOcc 0
32 mol 107 unq 0 iso 0 dist 7.2168 13.076 6.49371 13.4265 8.49625 5.33764 15.3177 8.19484 3.40943 7.89505 numMergedOcc 0
33 mol 194 unq 0 iso 0 dist 7.56217 5.39223 4.45769 5.4455 3.7326 4.19371 11.7008 5.10542 9.23342 8.43182 numMergedOcc 0
34 mol 194 unq 1 iso 0 dist 7.56217 7.15294 8.99961 5.4455 3.7326 9.71015 11.7008 5.10542 11.7699 8.43182 numMergedOcc 0
35 mol 194 unq 2 iso 0 dist 9.81055 5.39223 5.89939 5.4455 7.29209 4.19371 11.7008 4.68722 9.23342 8.43182 numMergedOcc 0
36 mol 194 unq 3 iso 0 dist 9.81055 7.15294 8.18853 5.4455 7.29209 9.71015 11.7008 4.68722 11.7699 8.43182 numMergedOcc 0
37 mol 214 unq 0 iso 0 dist 9.53899 10.0389 7.66702 13.8459 7.23583 5.44533 15.5354 10.7359 7.87816 5.05626 numMergedOcc 0
38 mol 214 unq 1 iso 0 dist 9.53899 10.0389 7.66702 13.8459 7.23583 5.44533 6.49466 7.42759 3.64285 8.41013 numMergedOcc 0
39 mol 260 unq 0 iso 0 dist 6.90472 13.8859 7.49606 10.4828 7.28821 9.31888 11.9315 8.62655 7.35802 6.49413 numMergedOcc 0
40 mol 260 unq 1 iso 0 dist 6.90472 13.8859 7.49606 10.4828 7.28821 9.31888 15.7011 11.9844 9.94995 6.12343 numMergedOcc 0
41 mol 260 unq 2 iso 0 dist 6.90472 13.8859 7.49606 10.4828 7.28821 9.31888 8.79837 9.01781 12.8784 4.52405 numMergedOcc 0
42 mol 292 unq 0 iso 0 dist 9.25289 14.8716 9.21469 12.9862 4.30125 8.6233 18.3869 12.6751 11.0273 9.373 numMergedOcc 0
43 mol 292 unq 1 iso 0 dist 9.29687 14.3247 9.21469 8.67838 4.30125 8.6233 9.75548 12.6751 11.0273 9.373 numMergedOcc 0
