%chk=000291767.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000291767

0 1
O -3.027014 1.761420 -0.856158
O -2.683415 -1.904465 -1.291135
O 4.797720 -0.213225 -0.310515
O -4.172777 0.518361 0.654660
O -2.018989 -2.412828 0.812603
O 3.963835 1.681124 -1.235097
N 2.486037 -0.929844 0.873819
C 0.433131 0.030383 0.891595
C -1.001150 0.279869 1.173284
C 1.290162 0.861404 0.115181
C -1.887113 -0.100066 -0.035956
C 1.195684 -1.070595 1.351454
C 2.564157 0.253900 0.105383
C 0.934704 2.128894 -0.548240
C 0.787152 -2.202077 2.204548
C -3.174566 0.702592 0.004660
C -2.182362 -1.588963 -0.054372
C 3.776257 0.698141 -0.552359
C -4.129664 2.720206 -0.967115
C -3.048381 -3.298583 -1.557973
C 6.115967 0.084042 -0.865119
C -4.136993 3.639594 0.235077
C -1.801462 -4.107485 -1.843503
C 6.815054 1.114482 -0.002433
H -1.334920 -0.287037 2.071351
H -1.150342 1.354975 1.417900
H -1.332353 0.155699 -0.988168
H 3.270659 -1.541597 1.021340
H 0.779880 2.933452 0.187053
H 1.734204 2.472879 -1.231312
H 0.009324 2.046042 -1.136829
H -0.242165 -2.536530 1.947384
H 0.761354 -1.914449 3.267523
H 1.434781 -3.082765 2.113653
H -5.072520 2.155979 -1.079643
H -3.860134 3.231613 -1.909610
H -3.701593 -3.171898 -2.441114
H -3.621013 -3.681824 -0.694737
H 5.989984 0.421313 -1.909958
H 6.589899 -0.913091 -0.826416
H -4.854994 4.458991 0.108334
H -3.149793 4.085753 0.410546
H -4.417729 3.096782 1.150672
H -1.175032 -3.627006 -2.606879
H -1.183062 -4.219449 -0.940657
H -2.049516 -5.114097 -2.200596
H 7.858738 1.252619 -0.306376
H 6.806213 0.828368 1.056608
H 6.316656 2.093498 -0.076459


%chk=000291767-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000291767

0 1
O -3.263191 2.022187 -0.638457
O -2.508286 -1.840152 -1.543362
O 4.857359 -0.440553 -0.124682
O -4.347590 0.218159 0.376073
O -1.904498 -2.237560 0.673104
O 4.111225 1.274830 -1.556110
N 2.456424 -0.767709 1.021179
C 0.427712 0.186394 0.764880
C -1.029077 0.531614 0.957970
C 1.329019 0.811315 -0.166739
C -1.937013 0.074797 -0.232499
C 1.156923 -0.789778 1.491813
C 2.593390 0.197191 0.009906
C 1.001057 1.906601 -1.148631
C 0.721310 -1.709090 2.597577
C -3.319915 0.726351 -0.123743
C -2.095571 -1.445894 -0.276133
C 3.863859 0.435643 -0.648471
C -4.514338 2.840210 -0.528852
C -2.771156 -3.301514 -1.742628
C 6.226677 -0.284587 -0.687940
C -4.597372 3.522920 0.838630
C -1.481004 -4.036546 -2.115287
C 7.013173 0.787757 0.073155
H -1.416129 0.069932 1.883104
H -1.146725 1.627527 1.056932
H -1.489782 0.409217 -1.183540
H 3.233725 -1.347102 1.336456
H 0.240487 2.597985 -0.741744
H 1.905136 2.477086 -1.415556
H 0.594521 1.495459 -2.093914
H -0.273815 -2.128218 2.372596
H 0.657702 -1.180145 3.568243
H 1.427691 -2.549522 2.722870
H -5.379424 2.176362 -0.702100
H -4.417967 3.565607 -1.352054
H -3.511102 -3.319498 -2.558271
H -3.214644 -3.704043 -0.815248
H 6.138656 -0.026410 -1.758055
H 6.676679 -1.284866 -0.575255
H -5.480750 4.187392 0.869470
H -3.699487 4.136050 1.028996
H -4.701459 2.777057 1.644380
H -1.013666 -3.585480 -3.007501
H -0.759321 -4.009990 -1.281904
H -1.708954 -5.094704 -2.342022
H 8.051156 0.833340 -0.306633
H 7.049750 0.559555 1.152715
H 6.551100 1.779323 -0.066822


