%chk=Reac_ener_freq.chk
%mem=64gb
%nprocshared=16
#p freq b3lyp/6-311++g(2d,2p) nosymm int=superfinegrid scf=xqc  iop(7/90=-1)

Title

-4  1
O	0	74.38942	40.94448	77.09504
H	0	73.59326	41.51294	77.15081
H	0	74.59403	40.65248	78.00128
O	0	71.90392	35.07805	80.50266
H	0	72.60217	34.924	81.15086
H	0	72.33067	34.82655	79.6315
O	0	70.51556	37.74705	79.56341
H	0	69.91984	37.43339	78.8128
H	0	69.94746	37.97327	80.30573
C	-1	73.23611	43.91973	78.73712
C	0	72.03292	43.66153	77.82067
O	0	72.11716	42.67795	77.03214
O	0	71.06931	44.46902	77.89854
H	-1	72.93692	44.15119	79.75994
H	0	73.77588	44.79246	78.35944
H	0	73.92408	43.07915	78.75422
C	-1	74.47603	35.99197	76.73699
C	0	73.60357	35.82127	77.97694
O	0	73.31352	36.85968	78.63002
O	0	73.20092	34.65412	78.24939
H	-1	75.29897	36.69002	76.89103
H	0	73.85514	36.40551	75.93917
H	0	74.8647	35.03143	76.40541
C	-1	70.0871	38.19898	76.08405
C	0	68.87322	37.36923	76.52191
O	0	68.84162	36.97562	77.73133
O	0	67.97998	37.14184	75.67258
H	-1	70.22493	38.09602	75.00799
H	0	70.99122	37.90406	76.61228
H	0	69.90241	39.25138	76.30739
P	0	71.73625	38.05374	83.55558
P	0	74.55893	37.46898	82.67155
P	0	74.37642	39.85438	80.9068
C	-1	71.40098	35.46303	83.91196
O	0	71.38945	36.78062	84.5068
O	0	71.24681	37.70663	82.17492
O	0	73.88972	36.55228	81.66921
O	0	74.1875	41.08385	81.79008
O	0	71.25377	39.28884	84.24499
O	0	75.58609	36.90455	83.58961
O	0	73.07661	39.17482	80.51483
O	0	73.36422	38.12445	83.60714
O	0	75.17567	38.74915	81.93268
O	0	75.35048	40.0759	79.76178
H	-1	71.45704	34.77705	84.75702
H	0	72.2765	35.32637	83.28374
H	0	70.49774	35.29602	83.33057
Mg	-1	72.35999	37.28908	80.46291
H	-1	71.26749	44.03774	86.90471
H	-1	78.45096	40.33277	80.80729
H	-1	76.77062	40.58116	84.80863
C	-1	71.71908	44.26497	85.93901
H	0	70.95287	44.1035	85.18101
C	0	72.20401	45.7055	85.89769
H	0	72.9701	45.88076	86.65581
H	0	72.62555	45.94353	84.9213
H	0	71.37616	46.38924	86.09304
O	0	72.74881	43.32395	85.64824
H	0	73.49802	43.4522	86.23684
C	-1	78.40589	41.16604	80.10603
H	0	79.22795	41.83795	80.37239
C	0	78.61945	40.64272	78.687
H	0	77.81209	39.96716	78.4066
H	0	78.63803	41.46772	77.97269
H	0	79.56633	40.10041	78.61484
O	0	77.21437	41.90999	80.25003
H	0	76.45958	41.28263	80.09286
C	-1	75.68298	40.60397	84.87694
H	0	75.3036	39.67359	84.46089
C	0	75.27829	40.73028	86.33734
H	0	74.19311	40.71336	86.44493
H	0	75.69051	39.90263	86.9176
H	0	75.65343	41.66335	86.76457
O	0	75.19035	41.71974	84.13882
H	0	75.02481	41.43359	83.20379
K	-1	72.44203	41.79292	83.54205