%chk=000296700.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000296700

0 1
O 0.123780 0.033579 -3.064378
N -1.314020 -1.117973 -0.686968
C -0.491788 -0.603009 0.450502
C -0.666458 0.215757 -0.829961
C -2.785905 -1.215823 -0.571315
C 0.770608 -1.330103 0.769745
C 0.382434 0.318677 -1.917050
C -3.492222 -0.141640 0.218654
C 1.232341 -2.391429 -0.022388
C 1.504950 -0.933338 1.899883
C 1.719739 0.855463 -1.521130
C 2.417617 -3.050405 0.314789
C 2.690732 -1.594250 2.228927
C -3.697661 -0.298917 1.597135
C -3.944317 1.020940 -0.422622
C 1.905142 1.619846 -0.360810
C 2.811799 0.589416 -2.363051
C 3.148809 -2.653712 1.438570
C -4.346604 0.700946 2.326878
C -4.592562 2.018329 0.311036
C 3.173623 2.114769 -0.046476
C 4.080076 1.079007 -2.042235
C -4.793427 1.861066 1.686165
C 4.260721 1.842303 -0.884249
H -1.002641 -0.218691 1.352956
H -1.267056 1.141224 -0.778368
H -2.995086 -2.224825 -0.138813
H -3.174690 -1.251832 -1.619939
H 0.660740 -2.700906 -0.901044
H 1.156660 -0.110367 2.519886
H 2.771871 -3.874419 -0.302613
H 3.259688 -1.283153 3.103019
H -3.358035 -1.203357 2.100090
H -3.797306 1.144824 -1.495332
H 1.064952 1.829445 0.300566
H 2.656418 -0.000234 -3.270670
H 4.072371 -3.167032 1.697533
H -4.507099 0.574139 3.396550
H -4.944638 2.918532 -0.190967
H 3.316685 2.709601 0.853570
H 4.925603 0.866883 -2.694356
H -5.299975 2.638041 2.255660
H 5.249427 2.225225 -0.633776


%chk=000296700-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000296700

0 1
O 1.129711 -1.125839 -2.374841
N -1.166719 -1.348058 -0.606022
C -0.369218 -1.036122 0.611910
C -0.301437 -0.140124 -0.675088
C -2.664783 -1.200981 -0.602699
C 0.705752 -1.981670 1.042306
C 0.880135 -0.145378 -1.613344
C -3.248201 -0.017972 0.160321
C 1.170725 -3.017088 0.189777
C 1.269210 -1.842466 2.337884
C 1.772138 1.066956 -1.598163
C 2.182457 -3.895435 0.633401
C 2.283930 -2.720184 2.777247
C -3.569357 -0.129302 1.539090
C -3.463822 1.227783 -0.486149
C 1.684207 2.071535 -0.596114
C 2.755355 1.191189 -2.617096
C 2.743935 -3.750686 1.924294
C -4.086313 0.974478 2.254933
C -3.980376 2.334685 0.225123
C 2.559629 3.178461 -0.617750
C 3.623765 2.299649 -2.642244
C -4.291151 2.211235 1.599543
C 3.527326 3.298215 -1.642069
H -0.880920 -0.520637 1.441438
H -0.779606 0.841173 -0.535078
H -3.049819 -2.151688 -0.191499
H -2.956651 -1.155667 -1.667485
H 0.726029 -3.113386 -0.805580
H 0.910002 -1.046208 3.002963
H 2.535924 -4.693000 -0.029721
H 2.711272 -2.605003 3.779898
H -3.428501 -1.091271 2.048369
H -3.239644 1.324585 -1.556174
H 0.952827 1.982314 0.213928
H 2.816343 0.399244 -3.371165
H 3.529910 -4.434985 2.263744
H -4.336093 0.868555 3.316659
H -4.147224 3.286439 -0.291724
H 2.491820 3.944379 0.162704
H 4.375576 2.388622 -3.434117
H -4.697105 3.066390 2.151393
H 4.204258 4.159858 -1.659203


