%chk=000208760.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000208760

0 1
O 1.126853 -1.600474 0.853189
O 4.305950 3.798199 -0.118664
O -5.677925 0.132975 -0.075490
O -5.125579 2.162992 -0.576844
N -0.151947 2.264400 -0.187375
N -4.858394 1.018569 -0.251525
C -0.735385 -0.082342 0.300885
C 1.617514 0.635796 0.318917
C 0.636461 -0.365880 0.453114
C -1.069346 1.278407 -0.039011
C 1.173805 1.973758 -0.001231
C -1.798937 -1.032347 0.494880
C 3.023376 0.386762 0.485412
C -2.465543 1.632163 -0.231723
C 2.141633 3.012757 -0.138190
C -3.421677 0.676083 -0.056530
C 3.477795 2.718330 0.036908
C -3.101452 -0.674783 0.322161
C 3.936835 1.390749 0.350670
C 0.746876 -2.763599 0.166896
C 0.390709 -2.776920 -1.184138
C 0.850317 -3.924431 0.945219
C 0.128521 -4.017308 -1.774584
C 0.587830 -5.147421 0.325606
C 0.225704 -5.195589 -1.026829
C 5.733344 3.610142 0.049038
H -1.536863 -2.048908 0.798555
H 3.329140 -0.636642 0.725719
H -2.705459 2.668032 -0.511438
H 1.807680 4.024283 -0.377408
H -3.924412 -1.381504 0.466021
H 4.998982 1.200299 0.477431
H 0.321343 -1.857465 -1.760821
H 1.133015 -3.859515 1.993767
H -0.152031 -4.061624 -2.827837
H 0.662612 -6.070243 0.902195
H 0.019429 -6.155376 -1.497783
H 6.109207 4.627916 -0.129032
H 6.117906 2.916046 -0.703255
H 5.958614 3.285111 1.068525


%chk=000208760-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000208760

0 1
O 0.869171 -1.619691 1.096675
O 4.345037 3.688040 -0.281320
O -5.880397 0.286685 -0.001898
O -5.211746 2.372135 -0.638825
N -0.223335 2.294545 -0.250327
N -4.967248 1.172989 -0.230356
C -0.883538 -0.024737 0.414735
C 1.499051 0.614924 0.402168
C 0.485543 -0.354371 0.604332
C -1.177599 1.337514 -0.029702
C 1.089064 1.953283 -0.031984
C -1.965720 -0.940103 0.657011
C 2.893010 0.343464 0.600241
C -2.549283 1.708383 -0.242930
C 2.093104 2.946989 -0.247130
C -3.552685 0.776156 -0.006891
C 3.443105 2.647727 -0.044963
C -3.283756 -0.556415 0.452337
C 3.848074 1.330144 0.383542
C 0.754075 -2.781751 0.276001
C 0.549545 -2.720689 -1.120085
C 0.903548 -4.013395 0.949163
C 0.487762 -3.930491 -1.848953
C 0.841331 -5.210538 0.204200
C 0.631494 -5.175657 -1.195538
C 5.777271 3.435494 -0.080760
H -1.740221 -1.947713 1.016758
H 3.189835 -0.655266 0.933141
H -2.778159 2.721088 -0.582397
H 1.786397 3.944252 -0.570308
H -4.121507 -1.233456 0.632715
H 4.905679 1.100368 0.542222
H 0.442406 -1.758096 -1.629766
H 1.064098 -4.016400 2.031385
H 0.327925 -3.893618 -2.931995
H 0.954894 -6.170643 0.719077
H 0.581514 -6.107134 -1.768572
H 6.266432 4.389700 -0.323113
H 6.146920 2.645307 -0.761736
H 5.995411 3.162375 0.969247


