%chk=000208809.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208809

0 1
O -6.729050 -0.685056 0.453225
O -1.100416 2.819507 0.017915
N -3.911920 -0.495970 0.029369
N -0.380493 0.713424 -0.492309
N 0.568959 -0.233996 -0.596797
C -2.488088 -0.253965 0.423931
C 2.214397 1.398602 0.183076
C 3.660577 1.635118 0.499855
C -1.767595 0.270680 -0.836939
C -4.499653 -1.648057 0.788643
C -4.744516 0.733946 0.244706
C 1.826789 0.069699 -0.288518
C 4.327729 0.385352 1.089938
C 2.853158 -0.983788 -0.429890
C 4.088582 -0.828685 0.237408
C 1.255653 2.363378 0.289584
C -5.934883 -1.876731 0.285738
C -6.171556 0.447804 -0.246083
C -0.147546 2.061897 -0.043602
C 2.627661 -2.124752 -1.215335
C 5.071787 -1.817511 0.115253
C 1.519348 3.759620 0.737078
C 3.615953 -3.105595 -1.330724
C 4.835591 -2.952750 -0.665824
H -2.006550 -1.199056 0.755957
H -2.375779 0.466899 1.262848
H -2.306963 1.148821 -1.266674
H -1.733739 -0.518377 -1.621239
H 4.181950 1.936227 -0.437200
H 3.786190 2.486392 1.200019
H -3.884334 -2.551182 0.589432
H -4.508043 -1.484716 1.887599
H -4.769475 1.059246 1.307416
H -4.299064 1.568926 -0.338957
H 3.929241 0.189260 2.110023
H 5.411935 0.573419 1.223249
H -5.951860 -2.172715 -0.778145
H -6.479818 -2.613988 0.900249
H -6.874377 1.257508 0.016229
H -6.200471 0.248471 -1.331697
H 1.674635 -2.247025 -1.734576
H 6.024763 -1.705396 0.628684
H 0.594082 4.364380 0.748737
H 2.224755 4.272286 0.068212
H 1.930962 3.789812 1.755636
H 3.433275 -3.988847 -1.940187
H 5.605317 -3.717818 -0.756314


%chk=000208809-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000208809

0 1
O -6.787998 -0.685618 0.461849
O -1.152633 2.867097 0.104294
N -3.916881 -0.508568 0.065794
N -0.379805 0.737388 -0.495967
N 0.572143 -0.242627 -0.618197
C -2.493397 -0.267457 0.384295
C 2.209021 1.398474 0.195011
C 3.677219 1.653615 0.490948
C -1.756534 0.322155 -0.843825
C -4.519234 -1.627074 0.835820
C -4.753704 0.714484 0.196745
C 1.837664 0.076540 -0.279851
C 4.365820 0.400080 1.081227
C 2.863820 -0.983979 -0.431696
C 4.124402 -0.828802 0.217547
C 1.229616 2.379513 0.321084
C -5.949291 -1.888810 0.333001
C -6.180830 0.424570 -0.293565
C -0.168037 2.062943 -0.006768
C 2.607467 -2.151137 -1.198605
C 5.104308 -1.837784 0.072967
C 1.506081 3.791235 0.785772
C 3.589299 -3.152567 -1.327343
C 4.845474 -2.996484 -0.692260
H -2.016732 -1.228955 0.650774
H -2.366620 0.424065 1.251316
H -2.284477 1.217564 -1.207017
H -1.692210 -0.431107 -1.643064
H 4.185649 1.932174 -0.455955
H 3.789185 2.511650 1.176196
H -3.906699 -2.536862 0.689718
H -4.555096 -1.404420 1.931962
H -4.792393 1.061065 1.259704
H -4.314932 1.532073 -0.403220
H 3.964749 0.218112 2.100040
H 5.449561 0.583483 1.195763
H -5.912721 -2.207832 -0.731285
H -6.449582 -2.663538 0.937513
H -6.843176 1.289948 -0.126616
H -6.158239 0.172021 -1.375661
H 1.633207 -2.253266 -1.685746
H 6.075482 -1.715064 0.567752
H 0.581169 4.385077 0.714690
H 2.291121 4.275001 0.176236
H 1.846874 3.812457 1.838860
H 3.383092 -4.047652 -1.924263
H 5.615895 -3.768482 -0.796978


