%chk=000212644.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000212644

0 1
O 3.012900 -1.042057 1.001258
N 1.709292 0.593252 0.084063
C -0.550977 -0.394052 -0.598448
C -1.922395 -0.443900 0.195510
C -1.767702 1.042439 0.694310
C 0.440909 0.008276 0.562699
C -0.762145 0.848701 -1.517564
C -0.390393 1.023915 1.407232
C -1.578229 1.827440 -0.633362
C -0.138756 -1.647052 -1.333463
C -3.154866 -0.674453 -0.683213
C -1.970977 -1.475265 1.325952
C 2.938784 -0.017108 0.343557
C 4.135327 0.690927 -0.234499
H -2.587430 1.411405 1.318440
H 0.689706 -0.900281 1.173031
H -1.313529 0.570243 -2.429089
H 0.185023 1.283618 -1.861055
H 0.068585 2.022276 1.444632
H -0.476290 0.691756 2.452740
H -1.052172 2.779187 -0.474791
H -2.546799 2.078897 -1.090855
H -0.030638 -2.498593 -0.648928
H -0.874295 -1.931609 -2.094052
H 0.828046 -1.517515 -1.835124
H -4.076327 -0.528463 -0.108937
H -3.168157 -1.697276 -1.076602
H -3.203882 -0.002054 -1.544823
H -2.868266 -1.340382 1.939852
H -1.112015 -1.425901 2.003061
H -1.995322 -2.495106 0.924537
H 1.639274 1.428945 -0.485962
H 5.054360 0.145260 0.036717
H 4.103010 0.740555 -1.329392
H 4.243445 1.711677 0.152068


%chk=000212644-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000212644

0 1
O 2.993113 -1.257182 0.775485
N 1.729368 0.590461 0.120220
C -0.546527 -0.380190 -0.587973
C -1.922260 -0.430680 0.205536
C -1.800976 1.061208 0.690486
C 0.435766 0.056759 0.565886
C -0.762095 0.861556 -1.514042
C -0.416648 1.078747 1.403930
C -1.630916 1.842902 -0.646236
C -0.099995 -1.646674 -1.321299
C -3.155737 -0.703518 -0.690223
C -1.970285 -1.465036 1.358030
C 2.926902 -0.099152 0.261446
C 4.158007 0.652709 -0.250624
H -2.634160 1.419583 1.319314
H 0.699343 -0.833287 1.162952
H -1.286114 0.564858 -2.440513
H 0.198456 1.303819 -1.837394
H 0.032096 2.090091 1.392037
H -0.481783 0.768472 2.461205
H -1.137224 2.818361 -0.480908
H -2.604947 2.050006 -1.123906
H 0.020170 -2.497222 -0.625415
H -0.826226 -1.936058 -2.104188
H 0.879076 -1.491514 -1.812032
H -4.086066 -0.560412 -0.107789
H -3.149071 -1.750964 -1.046692
H -3.215210 -0.051396 -1.577444
H -2.935582 -1.386910 1.893406
H -1.169217 -1.342599 2.105397
H -1.898153 -2.494057 0.958428
H 1.752139 1.525050 -0.292180
H 5.049400 0.034511 -0.071149
H 4.078484 0.855602 -1.334879
H 4.283974 1.619860 0.270626


