%chk=000225122.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000225122

0 1
O -0.915514 -0.806589 2.429847
O -0.248815 -1.574379 -2.227271
N 0.776772 0.203876 0.117945
C 0.005109 -1.057304 0.157921
C -0.027357 1.354809 -0.415113
C 2.068385 0.029298 -0.628623
C 0.527131 2.652948 0.196672
C 3.082678 -0.683019 0.281181
C -1.086088 -0.988547 1.258095
C -0.751304 -1.421203 -1.145859
C -2.397125 -1.268615 0.579174
C -2.202466 -1.528241 -0.798471
C -0.287009 3.868186 -0.261255
C 4.440116 -0.825570 -0.416343
C 0.260719 5.166846 0.347886
C 5.460901 -1.531279 0.487683
C -3.663202 -1.305078 1.138384
C -3.271983 -1.828456 -1.625841
C -4.753652 -1.606602 0.297941
C -4.561531 -1.864586 -1.058950
C -0.542862 6.384724 -0.102268
C 6.817100 -1.676930 -0.198764
H 0.707719 -1.896954 0.418718
H -0.016049 1.409660 -1.524920
H -1.091764 1.237734 -0.116986
H 1.936602 -0.526587 -1.584235
H 2.457090 1.036323 -0.898626
H 0.515375 2.570798 1.303239
H 1.593234 2.779572 -0.074515
H 3.189316 -0.116655 1.228859
H 2.698794 -1.678795 0.577603
H -0.276830 3.940259 -1.365809
H -1.349694 3.743188 0.023304
H 4.324482 -1.390086 -1.361938
H 4.825238 0.171091 -0.706202
H 0.247375 5.097670 1.453676
H 1.324311 5.295732 0.066783
H 5.578970 -0.966681 1.433578
H 5.079860 -2.529911 0.778219
H -3.811293 -1.105916 2.200792
H -3.119032 -2.030801 -2.686692
H -5.758956 -1.638224 0.720226
H -5.416812 -2.098095 -1.694300
H -0.144293 7.305848 0.337736
H -0.519398 6.504795 -1.191242
H -1.594442 6.307708 0.196566
H 7.538233 -2.182279 0.453413
H 6.742010 -2.263706 -1.121344
H 7.242251 -0.702375 -0.464273


%chk=000225122-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000225122

0 1
O -0.995833 -0.393297 2.219801
O -0.710157 -1.035098 -2.567641
N 0.692200 0.330616 -0.202084
C -0.162554 -0.838975 -0.115814
C 0.025226 1.593432 -0.603436
C 2.048815 0.100631 -0.758389
C 0.603270 2.830406 0.117472
C 2.984114 -0.643047 0.219715
C -1.191706 -0.836168 1.061837
C -1.051035 -1.175239 -1.362892
C -2.454004 -1.449523 0.549566
C -2.377841 -1.634035 -0.858525
C -0.112111 4.136900 -0.294931
C 4.403813 -0.841224 -0.357752
C 0.476218 5.391253 0.390810
C 5.343947 -1.611420 0.597482
C -3.609133 -1.820689 1.270078
C -3.455231 -2.196715 -1.576697
C -4.690609 -2.378591 0.552135
C -4.613967 -2.565518 -0.857427
C -0.251811 6.692817 -0.009085
C 6.766747 -1.791454 0.025640
H 0.475280 -1.731828 0.059351
H 0.068089 1.744206 -1.708241
H -1.048094 1.512253 -0.339712
H 2.004053 -0.444298 -1.729551
H 2.488463 1.091363 -0.975034
H 0.515467 2.670334 1.208932
H 1.686004 2.925220 -0.103649
H 3.027806 -0.073284 1.167727
H 2.560708 -1.637678 0.473860
H -0.053392 4.262624 -1.396854
H -1.192012 4.060773 -0.047760
H 4.340316 -1.384368 -1.324263
H 4.850124 0.149286 -0.587386
H 0.427565 5.260391 1.490857
H 1.552417 5.474419 0.135181
H 5.397463 -1.074730 1.566452
H 4.903855 -2.605536 0.817778
H -3.655482 -1.670135 2.353313
H -3.384230 -2.333664 -2.660400
H -5.604307 -2.669735 1.081812
H -5.470153 -2.997497 -1.387164
H 0.189117 7.574538 0.491467
H -0.194090 6.859790 -1.101476
H -1.322537 6.648153 0.266327
H 7.418458 -2.345135 0.726347
H 6.742798 -2.351440 -0.928447
H 7.240257 -0.811480 -0.173729


