%chk=000298883.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000298883

0 1
O 1.442808 -0.790989 0.846387
O 1.225963 2.425650 1.230819
O 1.792043 1.072591 -1.950382
O 4.867256 0.241198 0.048101
O 4.954410 -1.625937 -1.228116
N -0.811553 -0.442597 0.410664
N -2.226331 -2.049015 -0.429999
N -2.407293 1.496073 0.421038
N -4.629965 0.877520 -0.402226
N -5.179393 -1.301621 -1.138351
C 0.808353 1.474925 0.256516
C 0.397881 0.174868 1.007772
C 2.067738 1.090812 -0.561660
C 2.488624 -0.303050 -0.046497
C 3.752302 -0.268718 0.821792
C -2.043600 0.188533 0.202235
C -0.988691 -1.813536 0.011422
C -2.914340 -0.826854 -0.325760
C -4.253730 -0.434011 -0.628003
C -3.705293 1.753899 0.098696
C 5.397663 -0.540702 -0.951931
H 0.006143 1.901076 -0.386262
H 0.264446 0.310958 2.108828
H 2.874096 1.860421 -0.470401
H 2.567271 -1.060722 -0.859552
H 3.999323 -1.272522 1.212686
H 3.685179 0.462906 1.650453
H 0.468442 3.014041 1.468402
H 1.089604 0.421921 -2.177484
H -0.171115 -2.522025 0.087542
H -4.061147 2.787366 0.255858
H 6.229142 0.022781 -1.380796
H -4.937518 -2.268154 -1.298414
H -6.121317 -0.997885 -1.331174


%chk=000298883-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000298883

0 1
O 1.474878 -0.847632 0.842545
O 1.559714 2.245361 1.301725
O 1.204211 0.654704 -2.023950
O 4.863643 0.481381 -0.136871
O 5.479026 -1.735737 -0.597985
N -0.821362 -0.463294 0.303767
N -2.253560 -2.004481 -0.620088
N -2.385319 1.465964 0.514748
N -4.632489 0.917517 -0.326365
N -5.194321 -1.196393 -1.219915
C 0.833373 1.430897 0.325382
C 0.375812 0.097718 0.986771
C 1.850898 0.954023 -0.744605
C 2.506086 -0.286568 -0.098994
C 3.754253 0.016130 0.748978
C -2.058315 0.183791 0.170766
C -1.005276 -1.779737 -0.169273
C -2.922448 -0.783409 -0.409367
C -4.263653 -0.366024 -0.660875
C -3.695697 1.742793 0.230558
C 5.637241 -0.507574 -0.734340
H -0.009791 1.981651 -0.123905
H 0.156333 0.220839 2.061878
H 2.584515 1.740177 -0.971270
H 2.725808 -1.064288 -0.850545
H 4.067563 -0.893648 1.287816
H 3.572407 0.853637 1.436920
H 0.916677 2.805191 1.803952
H 0.504548 -0.037969 -1.898805
H -0.197459 -2.505700 -0.143016
H -4.039905 2.751290 0.478190
H 6.417381 -0.015222 -1.343967
H -4.939635 -2.149311 -1.471714
H -6.137734 -0.846871 -1.375943


