%chk=000257220.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257220

0 1
O -0.696199 2.042944 -0.000451
O -4.206011 1.453306 -0.000361
O -2.192603 3.745852 -0.000775
N -2.158643 0.207903 -0.000139
C 0.336208 -0.137085 -0.000112
C 1.687662 0.469046 -0.000174
C 0.283339 -1.618429 0.000135
C -0.782502 0.602994 -0.000213
C 2.328517 0.746095 -1.216782
C 0.266352 -2.315919 1.216965
C 2.328609 0.746014 1.216406
C 0.270786 -2.316475 -1.216429
C 3.611231 1.300678 -1.211549
C 0.239401 -3.713141 1.211861
C 3.611323 1.300597 1.211114
C 0.243801 -3.713693 -1.210785
C 4.253462 1.577609 -0.000232
C 0.229066 -4.412709 0.000675
C -2.879898 1.307322 -0.000343
C -1.997852 2.574844 -0.000609
C -4.988278 0.210241 -0.000159
H 1.826788 0.533359 -2.158654
H 0.271380 -1.770261 2.158387
H 1.826961 0.533175 2.158299
H 0.279292 -1.771252 -2.158078
H 4.110233 1.519229 -2.154382
H 0.226052 -4.257513 2.154716
H 4.110396 1.519079 2.153925
H 0.233877 -4.258495 -2.153434
H 5.251987 2.010608 -0.000256
H 0.209090 -5.500753 0.000887
H -4.764042 -0.366579 0.903026
H -4.763986 -0.366915 -0.903116
H -6.011198 0.604725 -0.000265


%chk=000257220-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257220

0 1
O -0.703963 2.112384 -0.051793
O -4.223610 1.391248 -0.005700
O -2.362478 3.805675 -0.074347
N -2.112164 0.244934 0.008062
C 0.368403 -0.105090 -0.006393
C 1.720214 0.500285 -0.150038
C 0.254997 -1.582886 0.148634
C -0.777945 0.673517 -0.016086
C 1.966509 1.626674 -0.988064
C -0.688661 -2.182681 1.030159
C 2.820161 -0.060786 0.564315
C 1.118530 -2.436390 -0.598586
C 3.262720 2.167001 -1.105264
C -0.764850 -3.584597 1.157692
C 4.113057 0.489905 0.454585
C 1.031814 -3.838553 -0.478801
C 4.342357 1.605939 -0.383514
C 0.090559 -4.420593 0.402141
C -2.865809 1.342912 -0.008164
C -2.067729 2.603948 -0.043838
C -4.915227 0.078131 0.012789
H 1.142641 2.073340 -1.550222
H -1.349632 -1.544200 1.621915
H 2.651145 -0.919996 1.221868
H 1.845710 -1.993308 -1.287178
H 3.430613 3.028817 -1.760248
H -1.488498 -4.026663 1.851533
H 4.939604 0.051335 1.024378
H 1.696177 -4.475865 -1.072679
H 5.347543 2.032549 -0.473287
H 0.027731 -5.509917 0.502199
H -4.659402 -0.468439 0.936431
H -4.611964 -0.520524 -0.862682
H -5.983951 0.328295 -0.020718


