%chk=000266722.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000266722

0 1
O 1.712863 0.893198 -1.318959
O 2.079008 -2.153870 -2.048941
O -1.861896 -1.179225 2.422270
O 3.084599 -2.607745 0.390183
O 2.956893 3.021885 0.579114
N -3.563137 0.147036 -1.083473
C -0.690725 0.406158 -1.307947
C -1.372643 -0.753266 -0.477503
C 0.696004 -0.023115 -1.890491
C -2.675615 -0.125880 0.092920
C 0.914467 -1.516149 -1.491749
C -1.614093 0.908810 -2.425458
C -0.302890 1.425064 -0.285287
C -0.384240 -1.269531 0.572848
C -1.485091 -1.907481 -1.472194
C -2.414780 1.140096 0.986286
C 0.870246 -1.647576 0.022016
C -3.026159 1.259676 -1.932421
C -1.097455 1.829794 0.778111
C -0.313018 -2.278955 -2.012349
C 1.073708 1.688267 -0.359652
C -0.587205 -1.465107 1.944736
C 1.873122 -2.162407 0.844268
C -4.968629 0.427540 -0.668877
C -0.523326 2.756567 1.672331
C 1.648878 2.589554 0.541910
C 0.810707 3.146643 1.536573
C 0.452446 -1.926069 2.780490
C 1.680396 -2.270567 2.239223
C 3.078089 -1.294552 -2.645159
C -2.205918 -1.675817 3.737163
C 3.893102 2.248329 -0.215640
H 0.809887 0.132154 -2.977820
H -3.184205 -0.895112 0.733016
H -1.690561 0.126981 -3.209799
H -1.166662 1.800917 -2.905865
H -2.461685 -2.313150 -1.694037
H -2.460587 0.809804 2.050728
H -3.247561 1.858680 0.863840
H -3.005659 2.237443 -1.402397
H -3.702220 1.378960 -2.806879
H -0.142139 -3.061556 -2.734080
H -5.103516 1.338476 -0.066430
H -5.351574 -0.429536 -0.091518
H -5.595798 0.512786 -1.571292
H -1.112723 3.151877 2.495990
H 1.251432 3.863210 2.229639
H 0.296966 -2.017831 3.853008
H 2.496478 -2.639936 2.857829
H 2.701488 -0.893620 -3.590264
H 3.909744 -1.986446 -2.825426
H 3.365746 -0.490541 -1.955434
H 3.072672 -2.706482 -0.619681
H -3.273036 -1.428969 3.798372
H -1.635921 -1.142129 4.503210
H -2.052075 -2.757392 3.794615
H 3.921530 1.214659 0.144616
H 4.838214 2.768611 -0.027594
H 3.611158 2.287638 -1.273386


%chk=000266722-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000266722

0 1
O 1.759198 1.004260 -1.229881
O 2.275753 -1.960433 -1.947429
O -1.880446 -1.286700 2.489137
O 3.300266 -2.194789 0.404307
O 2.988757 2.977164 0.885382
N -3.537590 0.143107 -1.197143
C -0.648906 0.471014 -1.268434
C -1.345644 -0.732825 -0.478205
C 0.742822 0.071688 -1.831406
C -2.699510 -0.123132 0.012125
C 0.988404 -1.430032 -1.463103
C -1.559906 0.966486 -2.425910
C -0.301628 1.490045 -0.218453
C -0.344900 -1.229202 0.601428
C -1.421154 -1.870876 -1.502508
C -2.518256 1.170119 0.925819
C 0.934665 -1.539933 0.066051
C -3.006840 1.265113 -2.004248
C -1.163082 1.863976 0.820284
C -0.213073 -2.211869 -2.027055
C 1.076268 1.758641 -0.226325
C -0.566786 -1.453883 1.985520
C 2.015581 -1.942775 0.889497
C -4.976305 0.279216 -0.907700
C -0.609945 2.729560 1.803017
C 1.645715 2.593932 0.762378
C 0.751086 3.105528 1.746058
C 0.507533 -1.876250 2.811466
C 1.787491 -2.099370 2.274606
C 2.615091 -1.682746 -3.345873
C -2.095437 -1.535512 3.913322
C 4.014401 2.087115 0.304463
H 0.812747 0.220844 -2.920963
H -3.232497 -0.878376 0.612268
H -1.575585 0.176911 -3.200521
H -1.106224 1.872219 -2.872298
H -2.379502 -2.318993 -1.777597
H -2.666961 0.868897 1.976113
H -3.344627 1.870275 0.683187
H -3.055078 2.238629 -1.456183
H -3.636553 1.377524 -2.907075
H -0.038913 -3.013654 -2.750812
H -5.240978 1.191052 -0.315485
H -5.328528 -0.604379 -0.346184
H -5.537894 0.328062 -1.858818
H -1.222484 3.076564 2.643394
H 1.183134 3.756835 2.513032
H 0.353193 -2.042281 3.881062
H 2.619162 -2.421017 2.908148
H 1.785106 -1.968578 -4.020019
H 3.495261 -2.306588 -3.565478
H 2.869782 -0.616414 -3.492196
H 3.250132 -2.130807 -0.602572
H -3.167621 -1.348649 4.079138
H -1.496416 -0.848240 4.542614
H -1.857384 -2.583551 4.181500
H 3.939109 1.069054 0.728946
H 4.973825 2.547027 0.586101
H 3.919273 2.031798 -0.793187


