%chk=000273798.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273798

0 1
O 2.533846 -2.779956 0.442629
N 1.467598 -0.932020 -0.399756
N -1.743008 0.672927 1.943940
C -0.946669 -0.732235 0.161094
C 0.169565 -0.293734 -0.816848
C -1.025629 -2.268774 0.285957
C 0.460154 1.234069 -0.851570
C -2.289285 -0.125448 -0.219100
C 0.214584 -3.021134 -0.207432
C 2.463396 0.074706 -0.192776
C 1.907298 1.358051 -0.465144
C -0.758691 -0.094399 1.567054
C 1.516803 -2.276873 0.009767
C -2.719146 0.691740 0.875864
C -3.070622 -0.243717 -1.350659
C 3.786626 -0.088492 0.196256
C 2.697418 2.487355 -0.349708
C -3.920524 1.381332 0.838510
C -4.292647 0.458668 -1.391567
C 4.573104 1.071357 0.306767
C 4.042832 2.333186 0.039298
C -4.707322 1.251293 -0.321501
H -0.089616 -0.659444 -1.842400
H -1.911544 -2.640897 -0.270068
H -1.222398 -2.540739 1.344862
H -0.191984 1.806122 -0.163921
H 0.273789 1.647051 -1.859997
H 0.122051 -3.259885 -1.288769
H 0.286237 -4.007951 0.301530
H 0.132750 -0.294716 2.152558
H -2.763486 -0.858817 -2.192921
H 4.191259 -1.079607 0.410148
H 2.294939 3.477315 -0.550474
H -4.240954 1.998978 1.676061
H -4.921040 0.376289 -2.277767
H 5.615790 0.973839 0.608880
H 4.672027 3.216103 0.132555
H -5.657699 1.782559 -0.378250


%chk=000273798-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000273798

0 1
O 2.606838 -2.867213 0.307102
N 1.455921 -0.929386 -0.340462
N -1.747194 0.763600 1.942602
C -0.974288 -0.743395 0.216667
C 0.162244 -0.319752 -0.783081
C -0.988404 -2.316649 0.347085
C 0.455654 1.211212 -0.888462
C -2.315710 -0.134873 -0.180759
C 0.221958 -3.015910 -0.339171
C 2.456061 0.069833 -0.158922
C 1.912711 1.344223 -0.464162
C -0.780353 -0.058722 1.581079
C 1.546283 -2.294914 -0.087806
C -2.717178 0.743917 0.865894
C -3.122097 -0.299549 -1.317770
C 3.793718 -0.093626 0.260195
C 2.712288 2.492412 -0.347434
C -3.920877 1.466812 0.804680
C -4.340951 0.427108 -1.391602
C 4.587842 1.074006 0.370092
C 4.060634 2.353327 0.072270
C -4.733750 1.297801 -0.344492
H -0.111570 -0.730032 -1.774869
H -1.925006 -2.708691 -0.085853
H -0.997445 -2.590100 1.417264
H -0.217545 1.797638 -0.237230
H 0.296352 1.569297 -1.920951
H 0.052734 -3.066233 -1.433758
H 0.331452 -4.050316 0.024013
H 0.091034 -0.228203 2.222480
H -2.836136 -0.974461 -2.133920
H 4.183772 -1.087277 0.487928
H 2.302236 3.482744 -0.575385
H -4.210976 2.132797 1.623018
H -4.987527 0.311565 -2.268563
H 5.630572 0.979833 0.693236
H 4.696105 3.240439 0.166690
H -5.679599 1.844840 -0.424540


