/usr/share/nwchem/libraries/maug-cc-pvqz is in nwchem-data 6.6+r27746-2.
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# Elements References
# -------- ----------
# H-Ar: E. Papajak, H. R. Leverentz, J. Zheng, and D. G. Truhlar, J. Chem. Theory Comput. 5, 1197-1202 (2009).
# H-Ar: E. Papajak, D. G. Truhlar, J. Chem. Theory Comput. 6, 597 (2010).
# H, Li-Ne: T.H. Dunning, Jr., J. Chem. Phys. 90, 1007 (1989).
# He: D.E. Woon and T.H. Dunning, Jr., J. Chem. Phys. 100, 2975 (1994).
# B - F: R.A. Kendall, T.H. Dunning, Jr. and R.J. Harrison, J. Chem. Phys. 96, 6796 (1992).
# Na - Mg: D.E. Woon and T.H. Dunning, Jr., to be published .
# Al - Ar: D.E. Woon and T.H. Dunning, Jr., J. Chem. Phys. 98, 1358 (1993).
# Al - Ar: T.H. Dunning, Jr., K.A. Peterson and A.K. Wilson, J. Chem. Phys. 114, 9244 (2001).
#
basis "H_maug-cc-pVQZ" SPHERICAL
H S
82.6400000 0.0020060
12.4100000 0.0153430
2.8240000 0.0755790
H S
0.7977000 1.0000000
H S
0.2581000 1.0000000
H S
0.0898900 1.0000000
H P
2.2920000 1.0000000
H P
0.8380000 1.0000000
H P
0.2920000 1.0000000
H D
2.0620000 1.0000000
H D
0.6620000 1.0000000
H F
1.3970000 1.0000000
end
basis "He_maug-cc-pVQZ" SPHERICAL
He S
528.5000000 0.0009400
79.3100000 0.0072140
18.0500000 0.0359750
5.0850000 0.1277820
He S
1.6090000 1.0000000
He S
0.5363000 1.0000000
He S
0.1833000 1.0000000
He P
5.9940000 1.0000000
He P
1.7450000 1.0000000
He P
0.5600000 1.0000000
He D
4.2990000 1.0000000
He D
1.2230000 1.0000000
He F
2.6800000 1.0000000
end
basis "Li_maug-cc-pVQZ" SPHERICAL
Li S
6601.0000000 0.0001170 -0.0000180
989.7000000 0.0009110 -0.0001420
225.7000000 0.0047280 -0.0007410
64.2900000 0.0191970 -0.0030200
21.1800000 0.0630470 -0.0101230
7.7240000 0.1632080 -0.0270940
3.0030000 0.3148270 -0.0573590
1.2120000 0.3939360 -0.0938950
0.4930000 0.1969180 -0.1210910
Li S
0.0951500 1.0000000
Li S
0.0479100 1.0000000
Li S
0.0222000 1.0000000
Li S
0.0063600 1.0000000
Li P
6.2500000 0.0033880
1.3700000 0.0193160
0.3672000 0.0791040
Li P
0.1192000 1.0000000
Li P
0.0447400 1.0000000
Li P
0.0179500 1.0000000
Li P
0.0075600 1.0000000
Li D
0.3440000 1.0000000
Li D
0.1530000 1.0000000
Li D
0.0680000 1.0000000
Li F
0.2460000 1.0000000
Li F
0.1292000 1.0000000
Li G
0.2380000 1.0000000
end
basis "Be_maug-cc-pVQZ" SPHERICAL
Be S
14630.0000000 0.0000920 -0.0000170
2191.0000000 0.0007130 -0.0001300
498.2000000 0.0037350 -0.0006790
140.9000000 0.0154680 -0.0028570
45.8600000 0.0528740 -0.0098130
16.4700000 0.1456940 -0.0286090
6.3190000 0.3026810 -0.0637600
2.5350000 0.4049360 -0.1172310
1.0350000 0.2223870 -0.1212020
Be S
0.2528000 1.0000000
Be S
0.1052000 1.0000000
Be S
0.0426100 1.0000000
Be S
0.0143900 1.0000000
Be P
14.0300000 0.0040990
3.1680000 0.0256260
0.9024000 0.1037680
Be P
0.3036000 1.0000000
Be P
0.1130000 1.0000000
Be P
0.0428600 1.0000000
Be P
0.0065000 1.0000000
Be D
1.0720000 1.0000000
Be D
0.4410000 1.0000000
Be D
0.1811000 1.0000000
Be F
0.4810000 1.0000000
Be F
0.2550000 1.0000000
Be G
0.4150000 1.0000000
end
basis "B_maug-cc-pVQZ" SPHERICAL
B S
23870.0000000 0.0000880 -0.0000180
3575.0000000 0.0006870 -0.0001390
812.8000000 0.0036000 -0.0007250
229.7000000 0.0149490 -0.0030630
74.6900000 0.0514350 -0.0105810
26.8100000 0.1433020 -0.0313650
10.3200000 0.3009350 -0.0710120
4.1780000 0.4035260 -0.1321030
1.7270000 0.2253400 -0.1230720
B S
0.4704000 1.0000000
B S
0.1896000 1.0000000
B S
0.0739400 1.0000000
B S
0.0272100 1.0000000
B P
22.2600000 0.0050950
5.0580000 0.0332060
1.4870000 0.1323140
B P
0.5071000 1.0000000
B P
0.1812000 1.0000000
B P
0.0646300 1.0000000
B P
0.0187800 1.0000000
B D
1.1100000 1.0000000
B D
0.4020000 1.0000000
B D
0.1450000 1.0000000
B F
0.8820000 1.0000000
B F
0.3110000 1.0000000
B G
0.6730000 1.0000000
end
basis "C_maug-cc-pVQZ" SPHERICAL
C S
33980.0000000 0.0000910 -0.0000190
5089.0000000 0.0007040 -0.0001510
1157.0000000 0.0036930 -0.0007850
326.6000000 0.0153600 -0.0033240
106.1000000 0.0529290 -0.0115120
38.1100000 0.1470430 -0.0341600
14.7500000 0.3056310 -0.0771730
6.0350000 0.3993450 -0.1414930
2.5300000 0.2170510 -0.1180190
C S
0.7355000 1.0000000
C S
0.2905000 1.0000000
C S
0.1111000 1.0000000
C S
0.0414500 1.0000000
C P
34.5100000 0.0053780
7.9150000 0.0361320
2.3680000 0.1424930
C P
0.8132000 1.0000000
C P
0.2890000 1.0000000
C P
0.1007000 1.0000000
C P
0.0321800 1.0000000
C D
1.8480000 1.0000000
C D
0.6490000 1.0000000
C D
0.2280000 1.0000000
C F
1.4190000 1.0000000
C F
0.4850000 1.0000000
C G
1.0110000 1.0000000
end
basis "N_maug-cc-pVQZ" SPHERICAL
N S
45840.0000000 0.0000920 -0.0000200
6868.0000000 0.0007170 -0.0001590
1563.0000000 0.0037490 -0.0008240
442.4000000 0.0155320 -0.0034780
144.3000000 0.0531460 -0.0119660
52.1800000 0.1467870 -0.0353880
20.3400000 0.3046630 -0.0800770
8.3810000 0.3976840 -0.1467220
3.5290000 0.2176410 -0.1163600
N S
1.0540000 1.0000000
N S
0.4118000 1.0000000
N S
0.1552000 1.0000000
N S
0.0546400 1.0000000
N P
49.3300000 0.0055330
11.3700000 0.0379620
3.4350000 0.1490280
N P
1.1820000 1.0000000
N P
0.4173000 1.0000000
N P
0.1428000 1.0000000
N P
0.0440200 1.0000000
N D
2.8370000 1.0000000
N D
0.9680000 1.0000000
N D
0.3350000 1.0000000
N F
2.0270000 1.0000000
N F
0.6850000 1.0000000
N G
1.4270000 1.0000000
end
basis "O_maug-cc-pVQZ" SPHERICAL
O S
61420.0000000 0.0000900 -0.0000200
9199.0000000 0.0006980 -0.0001590
2091.0000000 0.0036640 -0.0008290
590.9000000 0.0152180 -0.0035080
192.3000000 0.0524230 -0.0121560
69.3200000 0.1459210 -0.0362610
26.9700000 0.3052580 -0.0829920
11.1000000 0.3985080 -0.1520900
4.6820000 0.2169800 -0.1153310
O S
1.4280000 1.0000000
O S
0.5547000 1.0000000
O S
0.2067000 1.0000000
O S
0.0695900 1.0000000
O P
63.4200000 0.0060440
14.6600000 0.0417990
4.4590000 0.1611430
O P
1.5310000 1.0000000
O P
0.5302000 1.0000000
O P
0.1750000 1.0000000
O P
0.0534800 1.0000000
O D
3.7750000 1.0000000
O D
1.3000000 1.0000000
O D
0.4440000 1.0000000
O F
2.6660000 1.0000000
O F
0.8590000 1.0000000
O G
1.8460000 1.0000000
end
basis "F_maug-cc-pVQZ" SPHERICAL
F S
74530.0000000 0.0000950 -0.0000220
11170.0000000 0.0007380 -0.0001720
2543.0000000 0.0038580 -0.0008910
721.0000000 0.0159260 -0.0037480
235.9000000 0.0542890 -0.0128620
85.6000000 0.1495130 -0.0380610
33.5500000 0.3082520 -0.0862390
13.9300000 0.3948530 -0.1558650
5.9150000 0.2110310 -0.1109140
F S
1.8430000 1.0000000
F S
0.7124000 1.0000000
F S
0.2637000 1.0000000
F S
0.0859400 1.0000000
F P
80.3900000 0.0063470
18.6300000 0.0442040
5.6940000 0.1685140
F P
1.9530000 1.0000000
F P
0.6702000 1.0000000
F P
0.2166000 1.0000000
F P
0.0656800 1.0000000
F D
5.0140000 1.0000000
F D
1.7250000 1.0000000
F D
0.5860000 1.0000000
F F
3.5620000 1.0000000
F F
1.1480000 1.0000000
F G
2.3760000 1.0000000
end
basis "Ne_maug-cc-pVQZ" SPHERICAL
Ne S
99920.0000000 0.0000860 -0.0000200
14960.0000000 0.0006690 -0.0001580
3399.0000000 0.0035180 -0.0008240
958.9000000 0.0146670 -0.0035000
311.2000000 0.0509620 -0.0122330
111.7000000 0.1437440 -0.0370170
43.3200000 0.3045620 -0.0861130
17.8000000 0.4001050 -0.1583810
7.5030000 0.2186440 -0.1142880
Ne S
2.3370000 1.0000000
Ne S
0.9001000 1.0000000
Ne S
0.3301000 1.0000000
Ne S
0.1054000 1.0000000
Ne P
99.6800000 0.0065660
23.1500000 0.0459790
7.1080000 0.1734190
Ne P
2.4410000 1.0000000
Ne P
0.8339000 1.0000000
Ne P
0.2662000 1.0000000
Ne P
0.0817800 1.0000000
Ne D
6.4710000 1.0000000
Ne D
2.2130000 1.0000000
Ne D
0.7470000 1.0000000
Ne F
4.6570000 1.0000000
Ne F
1.5240000 1.0000000
Ne G
2.9830000 1.0000000
end
basis "Na_maug-cc-pVQZ" SPHERICAL
Na S
1224000.0000000 0.478894D-05 -0.116958D-05 0.175871D-06
183200.0000000 0.372395D-04 -0.909110D-05 0.136594D-05
41700.0000000 0.195831D-03 -0.478499D-04 0.719795D-05
11810.0000000 0.826698D-03 -0.201962D-03 0.303349D-04
3853.0000000 0.300251D-02 -0.735837D-03 0.110752D-03
1391.0000000 0.970310D-02 -0.238746D-02 0.358596D-03
542.5000000 0.282337D-01 -0.704969D-02 0.106272D-02
224.9000000 0.732058D-01 -0.187856D-01 0.282687D-02
97.9300000 0.162897D+00 -0.446153D-01 0.676742D-02
44.3100000 0.288708D+00 -0.897741D-01 0.136480D-01
20.6500000 0.346829D+00 -0.142940D+00 0.222814D-01
9.7290000 0.206865D+00 -0.124315D+00 0.196011D-01
4.2280000 0.328009D-01 0.999648D-01 -0.167708D-01
1.9690000 -0.647736D-03 0.417080D+00 -0.773734D-01
0.8890000 0.145878D-02 0.475123D+00 -0.113501D+00
0.3964000 -0.178346D-03 0.163268D+00 -0.139130D+00
Na S
0.0699300 1.0000000
Na S
0.0328900 1.0000000
Na S
0.0161200 1.0000000
Na S
0.0050300 1.0000000
Na P
413.4000000 0.908196D-03 -0.901741D-04
97.9800000 0.741773D-02 -0.739342D-03
31.3700000 0.357464D-01 -0.357309D-02
11.6200000 0.118520D+00 -0.120142D-01
4.6710000 0.261403D+00 -0.267178D-01
1.9180000 0.378395D+00 -0.392753D-01
0.7775000 0.334632D+00 -0.376083D-01
0.3013000 0.126844D+00 -0.433228D-01
0.2275000 -0.147117D-01 0.518003D-01
Na P
0.0752700 1.0000000
Na P
0.0312600 1.0000000
Na P
0.0134200 1.0000000
Na P
0.0077200 1.0000000
Na D
0.1538000 1.0000000
Na D
0.0865000 1.0000000
Na D
0.0487000 1.0000000
Na F
0.1912000 1.0000000
Na F
0.1036000 1.0000000
Na G
0.1722000 1.0000000
end
basis "Mg_maug-cc-pVQZ" SPHERICAL
Mg S
327600.0000000 0.309608D-04 -0.783173D-05 0.150908D-05
49050.0000000 0.240954D-03 -0.607935D-04 0.117134D-04
11150.0000000 0.126660D-02 -0.321197D-03 0.618980D-04
3152.0000000 0.533359D-02 -0.134955D-02 0.260088D-03
1025.0000000 0.190770D-01 -0.490570D-02 0.946218D-03
368.8000000 0.588058D-01 -0.153561D-01 0.296595D-02
143.2000000 0.151454D+00 -0.423409D-01 0.821245D-02
58.9600000 0.300716D+00 -0.940603D-01 0.183977D-01
25.4000000 0.381149D+00 -0.163425D+00 0.326657D-01
11.1500000 0.213584D+00 -0.124754D+00 0.257315D-01
4.0040000 0.231210D-01 0.235623D+00 -0.535351D-01
1.7010000 -0.230757D-02 0.577563D+00 -0.156895D+00
0.7060000 0.128900D-02 0.335232D+00 -0.206659D+00
Mg S
0.1410000 1.0000000
Mg S
0.0680800 1.0000000
Mg S
0.0306300 1.0000000
Mg S
0.0123900 1.0000000
Mg P
539.6000000 0.833969D-03 -0.132076D-03
127.9000000 0.689215D-02 -0.109538D-02
41.0200000 0.337874D-01 -0.539495D-02
15.2500000 0.114401D+00 -0.185572D-01
6.1660000 0.259514D+00 -0.427375D-01
2.5610000 0.385095D+00 -0.647684D-01
1.0600000 0.335373D+00 -0.627818D-01
0.4176000 0.110641D+00 -0.244912D-01
0.2690000 -0.121315D-01 0.104761D+00
Mg P
0.1223000 1.0000000
Mg P
0.0547600 1.0000000
Mg P
0.0238800 1.0000000
Mg P
0.0070600 1.0000000
Mg D
0.1060000 1.0000000
Mg D
0.1944000 1.0000000
Mg D
0.3570000 1.0000000
Mg F
0.1810000 1.0000000
Mg F
0.3590000 1.0000000
Mg G
0.3070000 1.0000000
end
basis "Al_maug-cc-pVQZ" SPHERICAL
Al S
419600.0000000 0.278219D-04 -0.723754D-05 0.167150D-05
62830.0000000 0.216330D-03 -0.561733D-04 0.129641D-04
14290.0000000 0.113754D-02 -0.296528D-03 0.685101D-04
4038.0000000 0.479635D-02 -0.124913D-02 0.288274D-03
1312.0000000 0.172389D-01 -0.455101D-02 0.105276D-02
470.5000000 0.538066D-01 -0.144393D-01 0.333878D-02
181.8000000 0.141326D+00 -0.403464D-01 0.939217D-02
74.4600000 0.289268D+00 -0.922618D-01 0.216047D-01
31.9000000 0.384825D+00 -0.164510D+00 0.395873D-01
13.9600000 0.232852D+00 -0.141296D+00 0.349180D-01
5.1800000 0.293330D-01 0.195365D+00 -0.528415D-01
2.2650000 -0.300574D-02 0.572475D+00 -0.191878D+00
0.9664000 0.166673D-02 0.374041D+00 -0.254115D+00
Al S
0.2447000 1.0000000
Al S
0.1184000 1.0000000
Al S
0.0502100 1.0000000
Al S
0.0183000 1.0000000
Al P
891.3000000 0.491755D-03 -0.888695D-04
211.3000000 0.415843D-02 -0.745823D-03
68.2800000 0.212538D-01 -0.387025D-02
25.7000000 0.764058D-01 -0.139350D-01
10.6300000 0.194277D+00 -0.366860D-01
4.6020000 0.334428D+00 -0.627797D-01
2.0150000 0.375026D+00 -0.789602D-01
0.8706000 0.204041D+00 -0.288589D-01
Al P
0.2972000 1.0000000
Al P
0.1100000 1.0000000
Al P
0.0398900 1.0000000
Al P
0.0121000 1.0000000
Al D
0.0804000 1.0000000
Al D
0.1990000 1.0000000
Al D
0.4940000 1.0000000
Al F
0.1540000 1.0000000
Al F
0.4010000 1.0000000
Al G
0.3570000 1.0000000
end
basis "Si_maug-cc-pVQZ" SPHERICAL
Si S
513000.0000000 0.260920D-04 -0.694880D-05 0.178068D-05
76820.0000000 0.202905D-03 -0.539641D-04 0.138148D-04
17470.0000000 0.106715D-02 -0.284716D-03 0.730005D-04
4935.0000000 0.450597D-02 -0.120203D-02 0.307666D-03
1602.0000000 0.162359D-01 -0.438397D-02 0.112563D-02
574.1000000 0.508913D-01 -0.139776D-01 0.358435D-02
221.5000000 0.135155D+00 -0.393516D-01 0.101728D-01
90.5400000 0.281292D+00 -0.914283D-01 0.237520D-01
38.7400000 0.385336D+00 -0.165609D+00 0.443483D-01
16.9500000 0.245651D+00 -0.152505D+00 0.419041D-01
6.4520000 0.343145D-01 0.168524D+00 -0.502504D-01
2.8740000 -0.334884D-02 0.569284D+00 -0.216578D+00
1.2500000 0.187625D-02 0.398056D+00 -0.286448D+00
Si S
0.3599000 1.0000000
Si S
0.1699000 1.0000000
Si S
0.0706600 1.0000000
Si S
0.0275000 1.0000000
Si P
1122.0000000 0.448143D-03 -0.964883D-04
266.0000000 0.381639D-02 -0.811971D-03
85.9200000 0.198105D-01 -0.430087D-02
32.3300000 0.727017D-01 -0.157502D-01
13.3700000 0.189839D+00 -0.429541D-01
5.8000000 0.335672D+00 -0.752574D-01
2.5590000 0.379365D+00 -0.971446D-01
1.1240000 0.201193D+00 -0.227507D-01
Si P
0.3988000 1.0000000
Si P
0.1533000 1.0000000
Si P
0.0572800 1.0000000
Si P
0.0200000 1.0000000
Si D
0.1200000 1.0000000
Si D
0.3020000 1.0000000
Si D
0.7600000 1.0000000
Si F
0.2120000 1.0000000
Si F
0.5410000 1.0000000
Si G
0.4610000 1.0000000
end
basis "P_maug-cc-pVQZ" SPHERICAL
P S
615200.0000000 0.247450D-04 -0.672205D-05 0.184740D-05
92120.0000000 0.192465D-03 -0.522311D-04 0.143380D-04
20950.0000000 0.101202D-02 -0.275361D-03 0.757228D-04
5920.0000000 0.427261D-02 -0.116307D-02 0.319205D-03
1922.0000000 0.154161D-01 -0.424281D-02 0.116851D-02
688.0000000 0.485976D-01 -0.136114D-01 0.374267D-02
265.0000000 0.130060D+00 -0.385114D-01 0.106817D-01
108.2000000 0.274514D+00 -0.906643D-01 0.252657D-01
46.2200000 0.385402D+00 -0.166584D+00 0.479283D-01
20.2300000 0.255934D+00 -0.161447D+00 0.477096D-01
7.8590000 0.391237D-01 0.146781D+00 -0.466525D-01
3.5470000 -0.368010D-02 0.566682D+00 -0.234968D+00
1.5640000 0.208211D-02 0.416433D+00 -0.311337D+00
P S
0.4888000 1.0000000
P S
0.2266000 1.0000000
P S
0.0933100 1.0000000
P S
0.0354000 1.0000000
P P
1367.0000000 0.421015D-03 -0.100827D-03
324.0000000 0.360985D-02 -0.854499D-03
104.6000000 0.189217D-01 -0.457116D-02
39.3700000 0.705560D-01 -0.170327D-01
16.2600000 0.188157D+00 -0.475204D-01
7.0560000 0.338709D+00 -0.852786D-01
3.1300000 0.381943D+00 -0.109676D+00
1.3940000 0.195261D+00 -0.161181D-01
P P
0.5179000 1.0000000
P P
0.2032000 1.0000000
P P
0.0769800 1.0000000
P P
0.0272000 1.0000000
P D
0.1650000 1.0000000
P D
0.4130000 1.0000000
P D
1.0360000 1.0000000
P F
0.2800000 1.0000000
P F
0.7030000 1.0000000
P G
0.5970000 1.0000000
end
basis "S_maug-cc-pVQZ" SPHERICAL
S S
727800.0000000 0.236025D-04 -0.652179D-05 0.189406D-05
109000.0000000 0.183482D-03 -0.506631D-04 0.146948D-04
24800.0000000 0.964278D-03 -0.266833D-03 0.775460D-04
7014.0000000 0.406537D-02 -0.112601D-02 0.326509D-03
2278.0000000 0.146973D-01 -0.411186D-02 0.119686D-02
814.7000000 0.465081D-01 -0.132454D-01 0.384799D-02
313.4000000 0.125508D+00 -0.377004D-01 0.110539D-01
127.7000000 0.268433D+00 -0.898554D-01 0.264645D-01
54.4800000 0.384809D+00 -0.167098D+00 0.508771D-01
23.8500000 0.265372D+00 -0.169354D+00 0.530030D-01
9.4280000 0.437326D-01 0.127824D+00 -0.425518D-01
4.2900000 -0.378807D-02 0.564862D+00 -0.250853D+00
1.9090000 0.218083D-02 0.431767D+00 -0.333152D+00
S S
0.6270000 1.0000000
S S
0.2873000 1.0000000
S S
0.1172000 1.0000000
S S
0.0428000 1.0000000
S P
1546.0000000 0.441183D-03 -0.113110D-03
366.4000000 0.377571D-02 -0.958581D-03
118.4000000 0.198360D-01 -0.513471D-02
44.5300000 0.742063D-01 -0.192641D-01
18.3800000 0.197327D+00 -0.535980D-01
7.9650000 0.351851D+00 -0.960333D-01
3.5410000 0.378687D+00 -0.118183D+00
1.5910000 0.170931D+00 0.923194D-02
S P
0.6205000 1.0000000
S P
0.2420000 1.0000000
S P
0.0901400 1.0000000
S P
0.0317000 1.0000000
S D
0.2030000 1.0000000
S D
0.5040000 1.0000000
S D
1.2500000 1.0000000
S F
0.3350000 1.0000000
S F
0.8690000 1.0000000
S G
0.6830000 1.0000000
end
basis "Cl_maug-cc-pVQZ" SPHERICAL
Cl S
834900.0000000 0.231688D-04 -0.649649D-05 0.196645D-05
125000.0000000 0.180154D-03 -0.504895D-04 0.152620D-04
28430.0000000 0.947782D-03 -0.266113D-03 0.806086D-04
8033.0000000 0.400139D-02 -0.112499D-02 0.339960D-03
2608.0000000 0.144629D-01 -0.410497D-02 0.124551D-02
933.9000000 0.456586D-01 -0.131987D-01 0.399612D-02
360.0000000 0.123248D+00 -0.375342D-01 0.114751D-01
147.0000000 0.264369D+00 -0.897233D-01 0.275504D-01
62.8800000 0.382989D+00 -0.167671D+00 0.532917D-01
27.6000000 0.270934D+00 -0.174763D+00 0.571246D-01
11.0800000 0.471404D-01 0.114909D+00 -0.395201D-01
5.0750000 -0.371766D-02 0.563618D+00 -0.264343D+00
2.2780000 0.219158D-02 0.441606D+00 -0.349291D+00
Cl S
0.7775000 1.0000000
Cl S
0.3527000 1.0000000
Cl S
0.1431000 1.0000000
Cl S
0.0519000 1.0000000
Cl P
1703.0000000 0.474039D-03 -0.128266D-03
403.6000000 0.406412D-02 -0.109356D-02
130.3000000 0.213355D-01 -0.583429D-02
49.0500000 0.794611D-01 -0.219258D-01
20.2600000 0.208927D+00 -0.601385D-01
8.7870000 0.364945D+00 -0.106929D+00
3.9190000 0.371725D+00 -0.122454D+00
1.7650000 0.146292D+00 0.383619D-01
Cl P
0.7207000 1.0000000
Cl P
0.2839000 1.0000000
Cl P
0.1060000 1.0000000
Cl P
0.0376000 1.0000000
Cl D
0.2540000 1.0000000
Cl D
0.6280000 1.0000000
Cl D
1.5510000 1.0000000
Cl F
0.4230000 1.0000000
Cl F
1.0890000 1.0000000
Cl G
0.8270000 1.0000000
end
basis "Ar_maug-cc-pVQZ" SPHERICAL
Ar S
950600.0000000 0.227545D-04 -0.646201D-05 0.202056D-05
142300.0000000 0.176945D-03 -0.502346D-04 0.156851D-04
32360.0000000 0.931282D-03 -0.264804D-03 0.828617D-04
9145.0000000 0.392860D-02 -0.111895D-02 0.349264D-03
2970.0000000 0.142064D-01 -0.408276D-02 0.127976D-02
1064.0000000 0.448114D-01 -0.131216D-01 0.410365D-02
410.8000000 0.121001D+00 -0.372855D-01 0.117789D-01
168.0000000 0.260579D+00 -0.894709D-01 0.283868D-01
71.9900000 0.381364D+00 -0.168054D+00 0.552406D-01
31.6700000 0.276058D+00 -0.179594D+00 0.607492D-01
12.8900000 0.505179D-01 0.102953D+00 -0.362012D-01
5.9290000 -0.359866D-02 0.562630D+00 -0.275398D+00
2.6780000 0.218798D-02 0.450355D+00 -0.362845D+00
Ar S
0.9416000 1.0000000
Ar S
0.4239000 1.0000000
Ar S
0.1714000 1.0000000
Ar S
0.0610000 1.0000000
Ar P
1890.0000000 0.495752D-03 -0.138863D-03
447.8000000 0.425172D-02 -0.118870D-02
144.6000000 0.223277D-01 -0.632553D-02
54.4600000 0.830878D-01 -0.238813D-01
22.5100000 0.217110D+00 -0.649238D-01
9.7740000 0.374507D+00 -0.115444D+00
4.3680000 0.366445D+00 -0.123651D+00
1.9590000 0.129245D+00 0.649055D-01
Ar P
0.8260000 1.0000000
Ar P
0.3297000 1.0000000
Ar P
0.1242000 1.0000000
Ar P
0.0435000 1.0000000
Ar D
0.3110000 1.0000000
Ar D
0.7630000 1.0000000
Ar D
1.8730000 1.0000000
Ar F
0.5430000 1.0000000
Ar F
1.3250000 1.0000000
Ar G
1.0070000 1.0000000
end
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