%chk=000273820.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000273820

0 1
O -1.914167 -2.578346 0.080030
O 1.031850 -2.510853 -1.381851
O -2.561325 0.608594 1.975570
O -3.080093 1.937850 -1.460865
O -0.487120 -1.708542 1.614139
O 2.942475 -1.380290 -0.999349
O -1.113342 2.310332 2.477409
O -2.756324 -0.103130 -2.456304
N -1.244032 1.508919 0.300102
N -1.660371 0.406088 -0.465422
N 0.696356 3.152568 0.607683
C 0.078351 2.043683 -0.171590
C 1.149594 0.921238 -0.255226
C -0.685020 -0.716648 -0.659467
C 0.777322 -0.320063 -0.629846
C 2.381332 1.527748 0.219179
C 2.055826 2.783876 0.836509
C 3.703664 1.086115 0.240525
C -0.971020 -1.690954 0.508750
C 1.731887 -1.391418 -0.980483
C 3.017552 3.554859 1.487201
C -1.576148 1.503026 1.694625
C -2.521281 0.699580 -1.580608
C 4.674696 1.869831 0.876068
C 4.334195 3.078635 1.494413
C -2.395419 -3.591394 1.022573
C 1.796269 -3.702623 -1.757079
C -2.944861 0.488095 3.395510
C -4.112304 2.284967 -2.451808
C -1.346755 -4.666510 1.212431
C 2.317675 -4.391946 -0.514754
C -1.861957 -0.249429 4.146405
C -3.473354 2.589070 -3.787555
H -0.120014 2.453460 -1.211862
H -0.930967 -1.247194 -1.636195
H 0.153370 3.515784 1.405529
H 3.982746 0.137012 -0.234670
H 2.757015 4.496491 1.962152
H 5.708349 1.528819 0.891574
H 5.108564 3.665008 1.992356
H -2.668077 -3.085913 1.965103
H -3.296913 -3.946759 0.489030
H 1.016790 -4.280442 -2.287513
H 2.602463 -3.396442 -2.447089
H -3.144570 1.498767 3.791061
H -3.881358 -0.089192 3.281931
H -4.843302 1.458965 -2.500297
H -4.548529 3.174146 -1.957231
H -0.980903 -5.042459 0.247553
H -0.475537 -4.276961 1.761415
H -1.741634 -5.518778 1.777035
H 3.105953 -3.794762 -0.030167
H 1.524400 -4.536698 0.230453
H 2.745144 -5.373719 -0.748229
H -2.233132 -0.686744 5.078868
H -1.017703 0.409777 4.397672
H -1.437379 -1.068338 3.535552
H -2.660803 3.321334 -3.693434
H -3.044936 1.681703 -4.242608
H -4.204388 2.994908 -4.498002


%chk=000273820-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000273820

0 1
O -1.747883 -2.778749 0.203808
O 1.192475 -2.692833 -1.404579
O -2.861328 0.671191 1.790766
O -3.002760 1.835826 -1.132667
O -0.151235 -1.805971 1.602605
O 3.063288 -1.306646 -1.572306
O -1.555460 2.549575 2.330497
O -2.795119 -0.170682 -2.348488
N -1.046289 1.191660 0.495894
N -1.471310 0.258017 -0.460266
N 0.839994 2.754614 0.973740
C 0.181412 1.863947 0.033886
C 1.277823 0.826403 -0.345204
C -0.562453 -0.885822 -0.678952
C 0.902230 -0.429153 -0.793494
C 2.541233 1.467519 0.031999
C 2.214658 2.590176 0.884473
C 3.905715 1.145333 -0.190277
C -0.751191 -1.863584 0.507812
C 1.847679 -1.450521 -1.271344
C 3.219436 3.362466 1.509457
C -1.804139 1.547240 1.603397
C -2.456157 0.583563 -1.405943
C 4.908350 1.920188 0.428759
C 4.565316 3.010461 1.273995
C -2.115944 -3.745017 1.284933
C 2.023160 -3.833858 -1.884997
C -3.704918 0.933426 2.996685
C -4.077883 2.280016 -2.072852
C -1.184329 -4.959954 1.266418
C 2.755702 -4.504978 -0.719148
C -3.076884 0.305027 4.242969
C -3.478485 2.936746 -3.318328
H -0.091770 2.421078 -0.895730
H -0.910265 -1.397278 -1.590001
H 0.304812 3.314702 1.638010
H 4.154597 0.303850 -0.839364
H 2.960536 4.209666 2.152465
H 5.962307 1.682556 0.252309
H 5.361185 3.598490 1.746089
H -2.071251 -3.218352 2.254885
H -3.156241 -4.014912 1.043414
H 1.289963 -4.507487 -2.357346
H 2.735089 -3.454579 -2.639220
H -3.825746 2.025008 3.110745
H -4.668474 0.468435 2.734402
H -4.694299 1.402684 -2.335759
H -4.663319 2.990479 -1.467896
H -1.182663 -5.436194 0.270784
H -0.153981 -4.664872 1.526259
H -1.529212 -5.705083 2.007362
H 3.484858 -3.813227 -0.265920
H 2.042542 -4.830471 0.057964
H 3.301896 -5.394701 -1.084436
H -3.763765 0.415373 5.102791
H -2.125016 0.801706 4.493604
H -2.885262 -0.770621 4.085896
H -2.815599 3.775165 -3.042451
H -2.906565 2.202736 -3.910092
H -4.290263 3.334924 -3.955113


