%chk=000291918.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291918

0 1
O 2.336144 -3.292620 1.939026
O -0.227193 2.537943 -1.042216
O 0.193665 -3.083643 1.770719
O -0.956901 1.954857 0.911152
O 5.343256 -0.333865 -0.269992
O 4.644261 1.567720 -1.038469
N -0.842347 -1.116710 0.420457
N 1.345042 -2.695312 1.568392
N -0.238728 1.819884 -0.061852
N 4.472506 0.485127 -0.505890
C 0.407360 -0.606566 0.440405
C -2.018331 -0.477351 -0.132097
C -3.066404 -0.057147 0.717114
C 1.526024 -1.443214 0.842818
C 0.752021 0.722715 -0.018725
C -2.125353 -0.367879 -1.530402
C -4.225874 0.465052 0.126481
C -4.342029 0.582387 -1.265020
C 2.839213 -1.073225 0.530695
C 2.053356 1.054090 -0.358765
C 3.099369 0.137578 -0.118407
C -3.281282 0.160898 -2.091306
C -2.931025 -0.129942 2.197858
C -5.586424 1.138481 -1.869941
H -1.026824 -2.049835 0.863333
H -1.305069 -0.695279 -2.171210
H -5.044689 0.797396 0.765115
H 3.679238 -1.744566 0.798418
H 2.291018 2.042067 -0.794285
H -3.364912 0.253960 -3.173666
H -3.850003 0.161513 2.725914
H -2.140186 0.564447 2.540753
H -2.666463 -1.134840 2.554226
H -6.343231 0.349716 -2.004483
H -5.412168 1.588903 -2.857586
H -6.043338 1.919059 -1.244162


%chk=000291918-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291918

0 1
O 2.246417 -3.445785 1.722261
O 0.166892 2.775216 -1.227819
O 0.073319 -2.833694 2.011992
O -0.884070 2.125597 0.695436
O 5.482399 -0.586927 -0.302096
O 4.858830 1.395425 -1.259140
N -0.847093 -0.790871 0.673798
N 1.284418 -2.609514 1.553716
N -0.007905 1.965458 -0.238345
N 4.601515 0.303612 -0.616936
C 0.458589 -0.444759 0.472566
C -2.020742 -0.282786 0.030950
C -3.203688 -0.119469 0.808604
C 1.539013 -1.357800 0.830175
C 0.898189 0.797342 -0.132983
C -2.031354 -0.048017 -1.366069
C -4.376849 0.295883 0.139916
C -4.411723 0.548659 -1.255501
C 2.876978 -1.112069 0.478550
C 2.221148 1.030098 -0.512337
C 3.202559 0.058344 -0.221452
C -3.215792 0.371215 -1.998342
C -3.183772 -0.341436 2.307482
C -5.698653 0.972441 -1.937360
H -0.947388 -1.614411 1.302864
H -1.125667 -0.216295 -1.959345
H -5.290584 0.439867 0.729457
H 3.651174 -1.837629 0.742340
H 2.500432 1.973426 -0.989980
H -3.214451 0.553717 -3.078680
H -4.156115 -0.082310 2.756972
H -2.406152 0.281775 2.786237
H -2.969855 -1.395742 2.572689
H -6.304497 0.090553 -2.223485
H -5.499132 1.546776 -2.858227
H -6.322687 1.595912 -1.273511


