%chk=000179088.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179088

0 1
O -3.447478 1.152519 0.158097
N 1.333378 0.405961 -0.496492
N 3.576113 0.936998 -0.062076
N 2.378586 -0.465882 1.530846
N 4.727843 0.080323 -0.015228
C 0.018342 -0.085236 -0.272131
C -2.326088 0.370805 0.000148
C -1.019298 0.852484 -0.112164
C -0.255205 -1.466970 -0.302387
C -2.626251 -1.007916 -0.029446
C -1.578087 -1.908429 -0.187811
C 2.361611 0.203527 0.291347
C -3.273963 2.590445 0.186195
H -0.785095 1.911319 -0.095480
H 0.545274 -2.181531 -0.456061
H -3.656945 -1.334852 0.064512
H -1.790094 -2.977976 -0.222244
H 3.449007 1.409636 -0.980399
H -2.847505 2.939425 -0.758920
H -2.657678 2.880563 1.042032
H -4.307349 2.939343 0.306258
H 1.650105 -1.149581 1.693328
H 3.275196 -0.723754 1.921237
H 5.387266 0.510099 0.647040
H 5.200916 0.036180 -0.922000


%chk=000179088-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000179088

0 1
O -3.549834 1.199260 0.189624
N 1.278234 0.550005 -0.435467
N 3.588260 0.659050 -0.326669
N 2.535084 -0.901779 1.070771
N 4.811032 0.331900 0.277602
C 0.002214 -0.019205 -0.233179
C -2.410015 0.383853 0.049484
C -1.097528 0.879823 -0.102396
C -0.257041 -1.424317 -0.228289
C -2.665426 -1.012057 0.066285
C -1.581515 -1.898355 -0.081939
C 2.383543 0.075480 0.104830
C -3.347956 2.647594 0.160114
H -0.877022 1.950158 -0.131402
H 0.562641 -2.131051 -0.400759
H -3.694390 -1.364772 0.179445
H -1.771058 -2.978321 -0.093627
H 3.489103 1.410242 -1.014927
H -2.909513 2.975012 -0.802996
H -2.695834 2.982069 0.991030
H -4.352155 3.081718 0.278216
H 1.714753 -1.345537 1.473494
H 3.478508 -1.070463 1.422465
H 5.219046 1.071229 0.860510
H 5.479469 -0.134036 -0.344018


