%nprocshared=12
%mem=22GB
%chk=carbonate_Toluene.chk
#p opt=(maxstep=5,tight) int=ultrafine freq WB97XD 6-311G(d,p) scrf(smd,solvent=Toluene)

Auto-generated custom job for carbonate_Toluene

0 1
C	1.021237	0.828499	-0.064336
O	0.364280	1.841288	-0.100629
O	0.520194	-0.391118	-0.000341
O	2.350867	0.898681	-0.091183
C	3.263036	-0.240595	0.017840
C	4.630090	0.431691	-0.040431
C	3.090428	-1.188005	-1.164984
C	3.076986	-0.942596	1.359261
H	4.752000	0.972163	-0.981967
H	5.420835	-0.318902	0.034735
H	4.743592	1.142075	0.781653
H	3.163678	-0.636948	-2.106375
H	2.130600	-1.700990	-1.131537
H	3.886272	-1.937589	-1.147649
H	3.149603	-0.219356	2.175852
H	3.866506	-1.687190	1.492656
H	2.113202	-1.446626	1.419237
H	-0.486183	-0.333071	-0.000870
N	-2.158950	-0.280051	-0.005420
C	-2.720274	0.930527	0.036707
C	-4.095302	1.112989	0.054081
C	-4.916212	-0.005891	0.023898
C	-4.333123	-1.265549	-0.023205
C	-2.949746	-1.354006	-0.035457
H	-2.023094	1.761741	0.053187
H	-4.508799	2.112995	0.090649
H	-5.994843	0.101841	0.036340
H	-4.934715	-2.165607	-0.049806
H	-2.451446	-2.317373	-0.071181


