%chk=000202953.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202953

0 1
O 3.783426 -1.087048 -0.031229
O -4.290423 0.000077 0.355258
N -2.388252 -0.003867 -0.988465
N -3.526570 -2.033360 -0.393287
C -1.195802 1.518721 0.636814
C 0.144451 0.867891 0.449893
C -2.076591 1.402861 -0.620721
C 0.369934 -0.436033 0.933464
C 1.175024 1.544021 -0.214225
C 1.599621 -1.056408 0.753938
C 2.423252 0.942457 -0.407537
C 2.621104 -0.354025 0.079803
C -3.457734 -0.620672 -0.286907
C 4.915394 -0.464197 -0.683696
H -1.732146 1.078922 1.505605
H -1.073440 2.590175 0.898079
H -1.572025 1.864509 -1.498583
H -3.035463 1.952339 -0.458402
H -0.427070 -0.963942 1.459423
H 1.009813 2.554329 -0.588039
H 1.794363 -2.060877 1.123078
H 3.209654 1.482842 -0.922635
H -1.552333 -0.566845 -1.169012
H 5.229888 0.426590 -0.132540
H 4.676203 -0.237236 -1.726312
H 5.674520 -1.254822 -0.617636
H -3.104517 -2.504414 -1.178574
H -4.405484 -2.447886 -0.101555


%chk=000202953-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000202953

0 1
O 3.872511 -1.124749 -0.042049
O -4.569784 0.026752 0.129132
N -2.406257 -0.068283 -0.773939
N -3.716421 -2.017068 -0.604464
C -1.174721 1.593200 0.676611
C 0.178307 0.919888 0.507510
C -2.124234 1.350799 -0.536663
C 0.410622 -0.394093 1.001868
C 1.233649 1.556074 -0.190940
C 1.642914 -1.046157 0.803439
C 2.479365 0.920370 -0.401125
C 2.682577 -0.390237 0.098144
C -3.618100 -0.639945 -0.384007
C 4.987689 -0.476314 -0.734662
H -1.682059 1.224711 1.587058
H -1.049184 2.687620 0.789583
H -1.678986 1.792900 -1.448909
H -3.096061 1.838468 -0.348809
H -0.379993 -0.902578 1.566708
H 1.086844 2.573924 -0.574105
H 1.827419 -2.052517 1.192290
H 3.271016 1.450560 -0.939313
H -1.626005 -0.662940 -1.057490
H 5.306508 0.445855 -0.210474
H 4.727064 -0.234247 -1.783800
H 5.804181 -1.213091 -0.717391
H -3.006435 -2.565768 -1.084436
H -4.593626 -2.459030 -0.343766


