%chk=000267626.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000267626

0 1
O -2.292768 1.258883 -2.139601
O -0.334641 -1.650456 1.097735
O -4.771194 -0.584587 1.232408
O 2.720616 2.535591 1.200183
O 0.853437 2.296880 0.127738
N -3.520750 0.360994 -0.460309
N -2.526667 -1.110203 1.158864
N 1.943032 1.895147 0.519888
C 1.427003 -0.258449 -0.636821
C -1.079750 -0.054735 -0.540951
C 0.120171 0.289308 -1.056668
C 2.326658 0.525766 0.113961
C 1.808610 -1.551271 -1.016484
C -2.287306 0.582265 -1.134497
C -1.221453 -0.989727 0.600677
C 3.580107 0.024179 0.494012
C 3.061790 -2.049983 -0.642959
C 3.944874 -1.266642 0.108417
C -3.696348 -0.449601 0.693013
H 0.172756 1.029543 -1.881378
H 1.118639 -2.178187 -1.584774
H 4.256482 0.648765 1.089576
H -4.362376 0.831023 -0.832128
H -2.639442 -1.725617 1.981132
H 3.347303 -3.063557 -0.935449
H 4.917615 -1.666131 0.401015


%chk=000267626-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000267626

0 1
O -2.215334 1.453502 -2.014456
O -0.439602 -1.574640 1.363183
O -5.017311 -0.924437 0.844986
O 3.186234 2.690959 0.937998
O 1.010148 2.427506 0.311059
N -3.577025 0.253594 -0.572454
N -2.707299 -1.220952 1.053819
N 2.222548 1.980513 0.466948
C 1.423315 -0.194458 -0.457312
C -1.138539 -0.020460 -0.394180
C 0.108350 0.391676 -0.807385
C 2.486350 0.581544 0.079200
C 1.711322 -1.547978 -0.772732
C -2.309076 0.628976 -1.063912
C -1.353240 -0.986361 0.719224
C 3.780037 0.061504 0.300457
C 2.998877 -2.083003 -0.567706
C 4.037080 -1.280769 -0.032357
C -3.851081 -0.648302 0.469121
H 0.100010 1.176612 -1.578417
H 0.915675 -2.175632 -1.183476
H 4.545337 0.710701 0.733577
H -4.392652 0.686262 -1.017044
H -2.882744 -1.872998 1.824927
H 3.192210 -3.130810 -0.819045
H 5.032809 -1.703352 0.132576


