%chk=000246224.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000246224

0 1
S 1.133546 1.822535 -0.906726
O -0.715644 0.990763 1.083298
O -3.667317 -0.639508 1.974022
O 0.812164 2.798150 0.095736
O 1.485190 2.206526 -2.253767
N -0.352644 0.907376 -1.190165
N -1.581385 0.392520 2.062765
C -3.268351 -0.643877 -1.163556
C -2.411096 -0.086270 -0.071320
C -3.271314 -2.189458 -1.120867
C -1.215461 0.573575 -0.173808
C -4.699495 -0.103211 -1.039860
C -2.748466 -0.182641 1.343991
C -1.923037 -2.783272 -1.517382
C 2.219981 0.646783 -0.317278
C 3.192638 0.106653 -1.171799
C 2.161446 0.225782 1.019592
C 4.035430 -1.269121 0.639940
C 4.094535 -0.843689 -0.700260
C 3.060621 -0.724992 1.496132
C 4.992698 -2.286574 1.157890
H -2.852804 -0.316076 -2.149980
H -3.549775 -2.527511 -0.101428
H -4.063147 -2.575617 -1.790556
H -5.340603 -0.467966 -1.847429
H -5.157875 -0.409300 -0.087873
H -4.716260 0.991180 -1.066714
H -1.653045 -2.530717 -2.547624
H -1.121525 -2.421916 -0.861711
H -1.938452 -3.876588 -1.440082
H -0.673722 0.703064 -2.149345
H -1.744927 1.129977 2.751717
H 3.248148 0.437649 -2.216607
H 1.400503 0.641787 1.696215
H 4.847069 -1.256642 -1.370441
H 3.005195 -1.049603 2.535032
H 4.465876 -3.173350 1.544861
H 5.701012 -2.642965 0.397424
H 5.592293 -1.886357 1.990762


%chk=000246224-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000246224

0 1
S 0.909087 0.605906 -1.222440
O -0.592631 -1.590410 1.115977
O -4.080943 -1.070682 1.788430
O 0.087461 1.726658 -0.368394
O 1.214309 0.770472 -2.814392
N -0.136959 -1.160985 -1.144159
N -1.774568 -1.586381 1.943092
C -3.335099 -0.378761 -1.228482
C -2.464237 -0.922872 -0.123682
C -4.551282 -1.310793 -1.515683
C -1.103265 -1.183824 -0.164507
C -3.796508 1.063181 -0.868110
C -2.937569 -1.182473 1.256312
C -4.148830 -2.704849 -2.040086
C 2.502712 0.220948 -0.318551
C 3.542130 -0.383867 -1.041080
C 2.596018 0.574103 1.037884
C 4.897679 -0.317268 1.020372
C 4.746804 -0.648150 -0.351796
C 3.810674 0.298553 1.699122
C 6.194424 -0.604080 1.753818
H -2.726941 -0.320207 -2.157607
H -5.145790 -1.407944 -0.588273
H -5.193918 -0.803031 -2.261443
H -4.407185 1.478615 -1.690345
H -4.409854 1.051169 0.049680
H -2.928236 1.725864 -0.704916
H -3.568018 -2.629388 -2.979999
H -3.531725 -3.250430 -1.302291
H -5.042237 -3.321045 -2.247803
H -0.525234 -1.166562 -2.105979
H -1.598402 -1.741929 2.935400
H 3.422775 -0.621923 -2.102505
H 1.757615 1.060153 1.546342
H 5.578257 -1.116833 -0.889581
H 3.916836 0.566548 2.756659
H 6.022771 -1.266011 2.622818
H 6.934633 -1.092086 1.098229
H 6.647245 0.327712 2.140767


