%chk=000281679.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000281679

0 1
O 3.209443 2.206334 -1.236309
O 3.861374 -2.117744 1.108320
O 5.128247 0.239442 -0.142371
O -5.424295 1.712632 1.415053
O -0.872109 1.230745 -2.192727
O -1.187385 -0.918826 -2.737262
N -2.924231 -2.697960 -0.942096
C 0.954952 -0.145942 0.298429
C -2.887058 -0.366662 -0.112339
C -1.447117 -0.224949 -0.418542
C -0.497822 -0.271793 0.525058
C 1.796626 -1.156330 0.777721
C 1.477960 0.960554 -0.374100
C -3.594451 -1.559634 -0.422157
C 2.871262 1.078449 -0.540440
C 3.187672 -1.038912 0.604637
C 3.747963 0.103512 -0.013499
C -3.546328 0.698441 0.503265
C -4.912269 0.577845 0.810817
C -4.966490 -1.647327 -0.102480
C -5.629439 -0.587870 0.513435
C -1.159294 -0.069632 -1.873134
C 4.565568 2.348583 -1.734973
C 5.251310 -2.316598 0.737815
C 5.724912 0.927594 0.996289
C -6.823409 1.701005 1.779835
H -0.780098 -0.436930 1.575526
H 1.399287 -2.042544 1.269155
H 0.825589 1.738032 -0.778891
H -3.020841 1.623052 0.743571
H -5.515390 -2.559912 -0.330014
H -6.684806 -0.679501 0.752865
H -3.518581 -3.348725 -1.440115
H -2.083673 -2.501297 -1.484954
H 4.952413 1.396618 -2.114975
H 5.198105 2.734969 -0.931672
H 4.434297 3.084376 -2.537022
H 5.881322 -1.729936 1.411158
H 5.430356 -2.040262 -0.306949
H 5.376045 -3.393751 0.900416
H 5.319507 1.939922 1.078741
H 6.786600 0.938443 0.731568
H 5.544231 0.362875 1.915214
H -7.019819 0.916815 2.516346
H -7.449386 1.592881 0.889695
H -6.945767 2.696862 2.225948
H -0.680983 1.353158 -3.164657


%chk=000281679-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000281679

0 1
O 3.688043 0.777497 -2.369399
O 3.785041 -0.294837 2.470754
O 5.213126 0.475140 0.072423
O -5.003720 0.188324 2.606112
O -0.705501 2.320277 -1.519542
O -1.338534 0.801823 -3.141243
N -3.457545 -1.005191 -2.716823
C 0.974854 -0.095287 0.017570
C -2.920400 -0.102447 -0.460106
C -1.477254 0.180481 -0.751890
C -0.486473 -0.273343 0.084308
C 1.717885 -0.303340 1.213249
C 1.689556 0.208223 -1.173451
C -3.839638 -0.667313 -1.418608
C 3.089120 0.379262 -1.160392
C 3.114860 -0.142903 1.233943
C 3.818061 0.242776 0.056907
C -3.376019 0.158841 0.857457
C -4.694981 -0.128849 1.263940
C -5.168557 -0.943030 -0.984262
C -5.601591 -0.688541 0.330902
C -1.174871 1.073596 -1.920033
C 4.851483 -0.008413 -2.837578
C 4.791694 -1.381281 2.505844
C 5.610490 1.673458 0.855939
C -6.367335 -0.087104 3.051666
H -0.833876 -0.880786 0.932248
H 1.215152 -0.576299 2.146962
H 1.189842 0.295246 -2.141817
H -2.699229 0.620797 1.583030
H -5.874164 -1.377351 -1.703597
H -6.635407 -0.918515 0.606345
H -4.155859 -1.398563 -3.342547
H -2.601341 -0.618282 -3.125680
H 4.548541 -1.055340 -3.032402
H 5.668864 0.020733 -2.098788
H 5.158114 0.471874 -3.779220
H 5.567877 -1.227201 1.735097
H 4.297621 -2.359742 2.354110
H 5.232694 -1.336912 3.513255
H 5.176394 2.581661 0.399466
H 6.709210 1.708598 0.800584
H 5.276669 1.576064 1.904236
H -6.609822 -1.166446 2.978073
H -7.110790 0.495806 2.471545
H -6.396460 0.225478 4.106298
H -0.501826 2.871461 -2.325686


