From owner-svn-ports-all@freebsd.org Sat Aug 25 06:36:27 2018 Return-Path: Delivered-To: svn-ports-all@mailman.ysv.freebsd.org Received: from mx1.freebsd.org (mx1.freebsd.org [IPv6:2610:1c1:1:606c::19:1]) by mailman.ysv.freebsd.org (Postfix) with ESMTP id 9795410A2CB0; Sat, 25 Aug 2018 06:36:27 +0000 (UTC) (envelope-from yuri@FreeBSD.org) Received: from mxrelay.nyi.freebsd.org (mxrelay.nyi.freebsd.org [IPv6:2610:1c1:1:606c::19:3]) (using TLSv1.2 with cipher ECDHE-RSA-AES256-GCM-SHA384 (256/256 bits)) (Client CN "mxrelay.nyi.freebsd.org", Issuer "Let's Encrypt Authority X3" (verified OK)) by mx1.freebsd.org (Postfix) with ESMTPS id 496AA8B767; Sat, 25 Aug 2018 06:36:27 +0000 (UTC) (envelope-from yuri@FreeBSD.org) Received: from repo.freebsd.org (repo.freebsd.org [IPv6:2610:1c1:1:6068::e6a:0]) (using TLSv1.2 with cipher ECDHE-RSA-AES256-GCM-SHA384 (256/256 bits)) (Client did not present a certificate) by mxrelay.nyi.freebsd.org (Postfix) with ESMTPS id 1FAE51C545; Sat, 25 Aug 2018 06:36:27 +0000 (UTC) (envelope-from yuri@FreeBSD.org) Received: from repo.freebsd.org ([127.0.1.37]) by repo.freebsd.org (8.15.2/8.15.2) with ESMTP id w7P6aRJA098992; Sat, 25 Aug 2018 06:36:27 GMT (envelope-from yuri@FreeBSD.org) Received: (from yuri@localhost) by repo.freebsd.org (8.15.2/8.15.2/Submit) id w7P6aQ38098989; Sat, 25 Aug 2018 06:36:26 GMT (envelope-from yuri@FreeBSD.org) Message-Id: <201808250636.w7P6aQ38098989@repo.freebsd.org> X-Authentication-Warning: repo.freebsd.org: yuri set sender to yuri@FreeBSD.org using -f From: Yuri Victorovich Date: Sat, 25 Aug 2018 06:36:26 +0000 (UTC) To: ports-committers@freebsd.org, svn-ports-all@freebsd.org, svn-ports-head@freebsd.org Subject: svn commit: r478004 - in head/science/nwchem: . files X-SVN-Group: ports-head X-SVN-Commit-Author: yuri X-SVN-Commit-Paths: in head/science/nwchem: . files X-SVN-Commit-Revision: 478004 X-SVN-Commit-Repository: ports MIME-Version: 1.0 Content-Type: text/plain; charset=UTF-8 Content-Transfer-Encoding: 8bit X-BeenThere: svn-ports-all@freebsd.org X-Mailman-Version: 2.1.27 Precedence: list List-Id: SVN commit messages for the ports tree List-Unsubscribe: , List-Archive: List-Post: List-Help: List-Subscribe: , X-List-Received-Date: Sat, 25 Aug 2018 06:36:28 -0000 Author: yuri Date: Sat Aug 25 06:36:26 2018 New Revision: 478004 URL: https://svnweb.freebsd.org/changeset/ports/478004 Log: science/nwchem: Add forgotten files Added: head/science/nwchem/files/ head/science/nwchem/files/nwchemrc.in (contents, props changed) head/science/nwchem/files/patch-config_makefile.h (contents, props changed) head/science/nwchem/pkg-plist (contents, props changed) Added: head/science/nwchem/files/nwchemrc.in ============================================================================== --- /dev/null 00:00:00 1970 (empty, because file is newly added) +++ head/science/nwchem/files/nwchemrc.in Sat Aug 25 06:36:26 2018 (r478004) @@ -0,0 +1,10 @@ +nwchem_basis_library %%PREFIX%%/share/nwchem/libraries/ +nwchem_nwpw_library %%PREFIX%%/share/nwchem/libraryps/ +ffield amber +amber_1 %%PREFIX%%/share/nwchem/data/amber_s/ +amber_2 %%PREFIX%%/share/nwchem/data/amber_q/ +amber_3 %%PREFIX%%/share/nwchem/data/amber_x/ +amber_4 %%PREFIX%%/share/nwchem/data/amber_u/ +spce %%PREFIX%%/share/nwchem/data/solvents/spce.rst +charmm_s %%PREFIX%%/share/nwchem/data/charmm_s/ +charmm_x %%PREFIX%%/share/nwchem/data/charmm_x/ Added: head/science/nwchem/files/patch-config_makefile.h ============================================================================== --- /dev/null 00:00:00 1970 (empty, because file is newly added) +++ head/science/nwchem/files/patch-config_makefile.h Sat Aug 25 06:36:26 2018 (r478004) @@ -0,0 +1,14 @@ +--- config/makefile.h.orig 2018-08-23 07:16:42 UTC ++++ config/makefile.h +@@ -1758,9 +1758,9 @@ endif + ifeq ($(USE_FLANG),1) + GNU_GE_4_6=true + else +- GNUMAJOR=$(shell $(_FC) -dM -E - < /dev/null 2> /dev/null | grep __GNUC__ |cut -c18) ++ GNUMAJOR=$(shell $(FC) -dM -E - < /dev/null 2> /dev/null | grep __GNUC__ |cut -c18) + ifdef GNUMAJOR +- GNUMINOR=$(shell $(_FC) -dM -E - < /dev/null 2> /dev/null | egrep __GNUC_MINOR | cut -c24) ++ GNUMINOR=$(shell $(FC) -dM -E - < /dev/null 2> /dev/null | egrep __GNUC_MINOR | cut -c24) + GNU_GE_4_6 = $(shell [ $(GNUMAJOR) -gt 4 -o \( $(GNUMAJOR) -eq 4 -a $(GNUMINOR) -ge 6 \) ] && echo true) + GNU_GE_4_8 = $(shell [ $(GNUMAJOR) -gt 4 -o \( $(GNUMAJOR) -eq 4 -a $(GNUMINOR) -ge 8 \) ] && echo true) + endif Added: head/science/nwchem/pkg-plist ============================================================================== --- /dev/null 00:00:00 1970 (empty, because file is newly added) +++ head/science/nwchem/pkg-plist Sat Aug 25 06:36:26 2018 (r478004) @@ -0,0 +1,1437 @@ +bin/nwchem +bin/nwchem.shadow +etc/nwchemrc +%%DATADIR%%/data/amber_q/ABE.frg +%%DATADIR%%/data/amber_q/BNZ.frg +%%DATADIR%%/data/amber_q/BTH.frg +%%DATADIR%%/data/amber_q/BTH.sgm +%%DATADIR%%/data/amber_q/BTO.frg +%%DATADIR%%/data/amber_q/BTO.sgm +%%DATADIR%%/data/amber_q/BUT.frg +%%DATADIR%%/data/amber_q/BUT.sgm +%%DATADIR%%/data/amber_q/CA.frg +%%DATADIR%%/data/amber_q/CTR.frg +%%DATADIR%%/data/amber_q/Ca.sgm +%%DATADIR%%/data/amber_q/DTT.frg +%%DATADIR%%/data/amber_q/EAM.frg +%%DATADIR%%/data/amber_q/FUC.sgm +%%DATADIR%%/data/amber_q/G31.frg +%%DATADIR%%/data/amber_q/G61.frg +%%DATADIR%%/data/amber_q/G64.frg +%%DATADIR%%/data/amber_q/GA1.frg +%%DATADIR%%/data/amber_q/GA2.frg +%%DATADIR%%/data/amber_q/GA3.frg +%%DATADIR%%/data/amber_q/GA3.sgm +%%DATADIR%%/data/amber_q/GAL.frg +%%DATADIR%%/data/amber_q/GAO.frg +%%DATADIR%%/data/amber_q/GC1.frg +%%DATADIR%%/data/amber_q/GC2.frg +%%DATADIR%%/data/amber_q/GC2.sgm +%%DATADIR%%/data/amber_q/GC3.sgm +%%DATADIR%%/data/amber_q/GCN.frg +%%DATADIR%%/data/amber_q/GDP.frg +%%DATADIR%%/data/amber_q/GL1.frg +%%DATADIR%%/data/amber_q/GL2.frg +%%DATADIR%%/data/amber_q/GL3.frg +%%DATADIR%%/data/amber_q/GL4.frg +%%DATADIR%%/data/amber_q/GL4.sgm +%%DATADIR%%/data/amber_q/GL5.frg 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+%%DATADIR%%/libraries/cc-pcvtzold +%%DATADIR%%/libraries/cc-pv5+dz +%%DATADIR%%/libraries/cc-pv5+dz-ri +%%DATADIR%%/libraries/cc-pv5z +%%DATADIR%%/libraries/cc-pv5z-dk +%%DATADIR%%/libraries/cc-pv5z-nr_mp2_fitting +%%DATADIR%%/libraries/cc-pv5z-pp +%%DATADIR%%/libraries/cc-pv5z-pp-ri +%%DATADIR%%/libraries/cc-pv5z-pp_mp2_fitting +%%DATADIR%%/libraries/cc-pv5z-ri +%%DATADIR%%/libraries/cc-pv5zfi_sf_fw +%%DATADIR%%/libraries/cc-pv5zfi_sf_lc +%%DATADIR%%/libraries/cc-pv5zfi_sf_sc +%%DATADIR%%/libraries/cc-pv5zpt_sf_fw +%%DATADIR%%/libraries/cc-pv5zpt_sf_lc +%%DATADIR%%/libraries/cc-pv5zpt_sf_sc +%%DATADIR%%/libraries/cc-pv6+dz +%%DATADIR%%/libraries/cc-pv6+dz-ri +%%DATADIR%%/libraries/cc-pv6z +%%DATADIR%%/libraries/cc-pv6z-ri +%%DATADIR%%/libraries/cc-pv8z +%%DATADIR%%/libraries/cc-pv9z +%%DATADIR%%/libraries/cc-pvd+dz +%%DATADIR%%/libraries/cc-pvd+dz-ri +%%DATADIR%%/libraries/cc-pvdz +%%DATADIR%%/libraries/cc-pvdz-dk +%%DATADIR%%/libraries/cc-pvdz-dk3 +%%DATADIR%%/libraries/cc-pvdz-f12 +%%DATADIR%%/libraries/cc-pvdz-f12_mp2_fitting +%%DATADIR%%/libraries/cc-pvdz-f12_optri +%%DATADIR%%/libraries/cc-pvdz-fit2-1 +%%DATADIR%%/libraries/cc-pvdz-pp +%%DATADIR%%/libraries/cc-pvdz-pp-ri +%%DATADIR%%/libraries/cc-pvdz-pp_mp2_fitting +%%DATADIR%%/libraries/cc-pvdz-ri +%%DATADIR%%/libraries/cc-pvdzfi_sf_fw +%%DATADIR%%/libraries/cc-pvdzfi_sf_lc +%%DATADIR%%/libraries/cc-pvdzfi_sf_sc +%%DATADIR%%/libraries/cc-pvdzpt_sf_fw +%%DATADIR%%/libraries/cc-pvdzpt_sf_lc +%%DATADIR%%/libraries/cc-pvdzpt_sf_sc +%%DATADIR%%/libraries/cc-pvdzseg-opt +%%DATADIR%%/libraries/cc-pvq+dz +%%DATADIR%%/libraries/cc-pvq+dz-ri +%%DATADIR%%/libraries/cc-pvqz +%%DATADIR%%/libraries/cc-pvqz-dk +%%DATADIR%%/libraries/cc-pvqz-dk3 +%%DATADIR%%/libraries/cc-pvqz-f12 +%%DATADIR%%/libraries/cc-pvqz-f12_mp2_fitting +%%DATADIR%%/libraries/cc-pvqz-f12_optri +%%DATADIR%%/libraries/cc-pvqz-nr_mp2_fitting +%%DATADIR%%/libraries/cc-pvqz-pp +%%DATADIR%%/libraries/cc-pvqz-pp-ri +%%DATADIR%%/libraries/cc-pvqz-pp_mp2_fitting +%%DATADIR%%/libraries/cc-pvqz-ri +%%DATADIR%%/libraries/cc-pvqzfi_sf_fw +%%DATADIR%%/libraries/cc-pvqzfi_sf_lc +%%DATADIR%%/libraries/cc-pvqzfi_sf_sc +%%DATADIR%%/libraries/cc-pvqzpt_sf_fw +%%DATADIR%%/libraries/cc-pvqzpt_sf_lc +%%DATADIR%%/libraries/cc-pvqzpt_sf_sc +%%DATADIR%%/libraries/cc-pvqzseg-opt +%%DATADIR%%/libraries/cc-pvt+dz +%%DATADIR%%/libraries/cc-pvt+dz+ +%%DATADIR%%/libraries/cc-pvt+dz-dk +%%DATADIR%%/libraries/cc-pvt+dz-ri +%%DATADIR%%/libraries/cc-pvtz +%%DATADIR%%/libraries/cc-pvtz-dk +%%DATADIR%%/libraries/cc-pvtz-dk3 +%%DATADIR%%/libraries/cc-pvtz-f12 +%%DATADIR%%/libraries/cc-pvtz-f12_mp2_fitting +%%DATADIR%%/libraries/cc-pvtz-f12_optri +%%DATADIR%%/libraries/cc-pvtz-fit2-1 +%%DATADIR%%/libraries/cc-pvtz-pp +%%DATADIR%%/libraries/cc-pvtz-pp-ri +%%DATADIR%%/libraries/cc-pvtz-pp_mp2_fitting +%%DATADIR%%/libraries/cc-pvtz-ri +%%DATADIR%%/libraries/cc-pvtz_mp2_fitting +%%DATADIR%%/libraries/cc-pvtzfi_sf_fw +%%DATADIR%%/libraries/cc-pvtzfi_sf_lc +%%DATADIR%%/libraries/cc-pvtzfi_sf_sc +%%DATADIR%%/libraries/cc-pvtzpt_sf_fw +%%DATADIR%%/libraries/cc-pvtzpt_sf_lc +%%DATADIR%%/libraries/cc-pvtzpt_sf_sc +%%DATADIR%%/libraries/cc-pvtzseg-opt +%%DATADIR%%/libraries/cc-pwcv5z +%%DATADIR%%/libraries/cc-pwcv5z-dk +%%DATADIR%%/libraries/cc-pwcv5z-nr +%%DATADIR%%/libraries/cc-pwcv5z-pp +%%DATADIR%%/libraries/cc-pwcv5z-pp_mp2_fitting +%%DATADIR%%/libraries/cc-pwcv5z-ri +%%DATADIR%%/libraries/cc-pwcv5z-ri_tight +%%DATADIR%%/libraries/cc-pwcv5z_core_set +%%DATADIR%%/libraries/cc-pwcv5z_tight +%%DATADIR%%/libraries/cc-pwcvdz +%%DATADIR%%/libraries/cc-pwcvdz-dk3 +%%DATADIR%%/libraries/cc-pwcvdz-pp +%%DATADIR%%/libraries/cc-pwcvdz-pp_mp2_fitting +%%DATADIR%%/libraries/cc-pwcvdz-ri +%%DATADIR%%/libraries/cc-pwcvdz-ri_tight +%%DATADIR%%/libraries/cc-pwcvdz_tight +%%DATADIR%%/libraries/cc-pwcvqz +%%DATADIR%%/libraries/cc-pwcvqz-dk +%%DATADIR%%/libraries/cc-pwcvqz-dk3 +%%DATADIR%%/libraries/cc-pwcvqz-nr +%%DATADIR%%/libraries/cc-pwcvqz-pp +%%DATADIR%%/libraries/cc-pwcvqz-pp_mp2_fitting +%%DATADIR%%/libraries/cc-pwcvqz-ri +%%DATADIR%%/libraries/cc-pwcvqz-ri_tight +%%DATADIR%%/libraries/cc-pwcvqz_tight +%%DATADIR%%/libraries/cc-pwcvtz +%%DATADIR%%/libraries/cc-pwcvtz-dk +%%DATADIR%%/libraries/cc-pwcvtz-dk3 +%%DATADIR%%/libraries/cc-pwcvtz-nr +%%DATADIR%%/libraries/cc-pwcvtz-nr_mp2_fitting +%%DATADIR%%/libraries/cc-pwcvtz-pp +%%DATADIR%%/libraries/cc-pwcvtz-pp_mp2_fitting +%%DATADIR%%/libraries/cc-pwcvtz-ri +%%DATADIR%%/libraries/cc-pwcvtz-ri_tight +%%DATADIR%%/libraries/cc-pwcvtz_tight +%%DATADIR%%/libraries/ccemd-2 +%%DATADIR%%/libraries/ccemd-3 +%%DATADIR%%/libraries/ccj-pv5z +%%DATADIR%%/libraries/ccj-pvdz +%%DATADIR%%/libraries/ccj-pvqz +%%DATADIR%%/libraries/ccj-pvtz +%%DATADIR%%/libraries/chipman_dzp_+_diffuse +%%DATADIR%%/libraries/coemd-2 +%%DATADIR%%/libraries/coemd-3 +%%DATADIR%%/libraries/coemd-4 +%%DATADIR%%/libraries/coemd-ref +%%DATADIR%%/libraries/cologne_dkh2 +%%DATADIR%%/libraries/core_valence_functions_cc-pcv5z +%%DATADIR%%/libraries/core_valence_functions_cc-pcv6z +%%DATADIR%%/libraries/core_valence_functions_cc-pcv6zold +%%DATADIR%%/libraries/core_valence_functions_cc-pcvdz +%%DATADIR%%/libraries/core_valence_functions_cc-pcvdzold +%%DATADIR%%/libraries/core_valence_functions_cc-pcvqz +%%DATADIR%%/libraries/core_valence_functions_cc-pcvqzold +%%DATADIR%%/libraries/core_valence_functions_cc-pcvtz +%%DATADIR%%/libraries/core_valence_functions_cc-pcvtzold +%%DATADIR%%/libraries/crenbl_ecp +%%DATADIR%%/libraries/crenbs_ecp +%%DATADIR%%/libraries/cvtz +%%DATADIR%%/libraries/d-aug-cc-pv5z +%%DATADIR%%/libraries/d-aug-cc-pv5z_diffuse +%%DATADIR%%/libraries/d-aug-cc-pv6z +%%DATADIR%%/libraries/d-aug-cc-pv6z_diffuse +%%DATADIR%%/libraries/d-aug-cc-pvdz +%%DATADIR%%/libraries/d-aug-cc-pvdz_diffuse +%%DATADIR%%/libraries/d-aug-cc-pvqz +%%DATADIR%%/libraries/d-aug-cc-pvqz_diffuse +%%DATADIR%%/libraries/d-aug-cc-pvtz +%%DATADIR%%/libraries/d-aug-cc-pvtz_diffuse +%%DATADIR%%/libraries/def2-ecp +%%DATADIR%%/libraries/def2-qzvp +%%DATADIR%%/libraries/def2-qzvpd +%%DATADIR%%/libraries/def2-qzvpp +%%DATADIR%%/libraries/def2-qzvppd +%%DATADIR%%/libraries/def2-svp +%%DATADIR%%/libraries/def2-svpd +%%DATADIR%%/libraries/def2-tzvp +%%DATADIR%%/libraries/def2-tzvpd +%%DATADIR%%/libraries/def2-tzvpp +%%DATADIR%%/libraries/def2-tzvppd +%%DATADIR%%/libraries/demon_coulomb_fitting +%%DATADIR%%/libraries/dgauss_a1_dft_coulomb_fitting +%%DATADIR%%/libraries/dgauss_a1_dft_exchange_fitting +%%DATADIR%%/libraries/dgauss_a2_dft_coulomb_fitting +%%DATADIR%%/libraries/dgauss_a2_dft_exchange_fitting +%%DATADIR%%/libraries/dhf-ecp +%%DATADIR%%/libraries/dhf-qzvp +%%DATADIR%%/libraries/dhf-qzvpp +%%DATADIR%%/libraries/dhf-svp +%%DATADIR%%/libraries/dhf-tzvp +%%DATADIR%%/libraries/dhf-tzvpp +%%DATADIR%%/libraries/dhms_polarization +%%DATADIR%%/libraries/dunning-hay_diffuse +%%DATADIR%%/libraries/dunning-hay_double_rydberg +%%DATADIR%%/libraries/dunning-hay_rydberg +%%DATADIR%%/libraries/dz_+_double_rydberg_dunning-hay +%%DATADIR%%/libraries/dz_+_rydberg_dunning +%%DATADIR%%/libraries/dz_dunning +%%DATADIR%%/libraries/dzp +%%DATADIR%%/libraries/dzp-dkh +%%DATADIR%%/libraries/dzp_+_diffuse_dunning +%%DATADIR%%/libraries/dzp_+_rydberg_dunning +%%DATADIR%%/libraries/dzp_dunning +%%DATADIR%%/libraries/dzq +%%DATADIR%%/libraries/dzvp2_dft_orbital +%%DATADIR%%/libraries/dzvp_dft_orbital +%%DATADIR%%/libraries/feller_misc._cvdz +%%DATADIR%%/libraries/feller_misc._cvqz +%%DATADIR%%/libraries/feller_misc._cvtz +%%DATADIR%%/libraries/g3largexp +%%DATADIR%%/libraries/g3mp2large +%%DATADIR%%/libraries/g3mp2largexp +%%DATADIR%%/libraries/gamess_pvtz +%%DATADIR%%/libraries/gamess_vtz +%%DATADIR%%/libraries/glendening_polarization +%%DATADIR%%/libraries/hay-wadt_mb_n+1_ecp +%%DATADIR%%/libraries/hay-wadt_vdz_n+1_ecp +%%DATADIR%%/libraries/hay_wadt_n-1_ecp +%%DATADIR%%/libraries/hondo7_polarization +%%DATADIR%%/libraries/huzinaga_polarization +%%DATADIR%%/libraries/iglo-ii +%%DATADIR%%/libraries/iglo-iii +%%DATADIR%%/libraries/jul-cc-pvd+dz +%%DATADIR%%/libraries/jul-cc-pvq+dz +%%DATADIR%%/libraries/jul-cc-pvt+dz +%%DATADIR%%/libraries/jun-cc-pvd+dz +%%DATADIR%%/libraries/jun-cc-pvq+dz +%%DATADIR%%/libraries/jun-cc-pvt+dz +%%DATADIR%%/libraries/lanl08 +%%DATADIR%%/libraries/lanl08+ +%%DATADIR%%/libraries/lanl08d +%%DATADIR%%/libraries/lanl08f +%%DATADIR%%/libraries/lanl2-10s8p7d3f2g +%%DATADIR%%/libraries/lanl2-5s4p4d2f +%%DATADIR%%/libraries/lanl2-6s4p4d2f +%%DATADIR%%/libraries/lanl2-[10s8p7d3f2g] +%%DATADIR%%/libraries/lanl2-[5s4p4d2f] +%%DATADIR%%/libraries/lanl2-[6s4p4d2f] +%%DATADIR%%/libraries/lanl2dz+1d1f +%%DATADIR%%/libraries/lanl2dz+2s2p2d2f +%%DATADIR%%/libraries/lanl2dz_ecp +%%DATADIR%%/libraries/lanl2dzdp_ecp +%%DATADIR%%/libraries/lanl2dzdp_ecp_polarization +%%DATADIR%%/libraries/lanl2tz +%%DATADIR%%/libraries/lanl2tz+ +%%DATADIR%%/libraries/lanl2tzf +%%DATADIR%%/libraries/m6-31g +%%DATADIR%%/libraries/m6-31gs +%%DATADIR%%/libraries/maug-cc-pvd+dz +%%DATADIR%%/libraries/maug-cc-pvdz +%%DATADIR%%/libraries/maug-cc-pvq+dz +%%DATADIR%%/libraries/maug-cc-pvqz +%%DATADIR%%/libraries/maug-cc-pvt+dz +%%DATADIR%%/libraries/maug-cc-pvtz +%%DATADIR%%/libraries/may-cc-pvq+dz +%%DATADIR%%/libraries/may-cc-pvt+dz +%%DATADIR%%/libraries/mclean_chandler_vtz +%%DATADIR%%/libraries/mg3s +%%DATADIR%%/libraries/midi! +%%DATADIR%%/libraries/midi_huzinaga +%%DATADIR%%/libraries/mini_huzinaga +%%DATADIR%%/libraries/mini_scaled +%%DATADIR%%/libraries/minis-bsip1 +%%DATADIR%%/libraries/modified_lanl2dz +%%DATADIR%%/libraries/nasa_ames_ano +%%DATADIR%%/libraries/nasa_ames_ano2 +%%DATADIR%%/libraries/nasa_ames_cc-pcv5z +%%DATADIR%%/libraries/nasa_ames_cc-pcvqz +%%DATADIR%%/libraries/nasa_ames_cc-pcvtz +%%DATADIR%%/libraries/nasa_ames_cc-pv5z +%%DATADIR%%/libraries/nasa_ames_cc-pvqz +%%DATADIR%%/libraries/nasa_ames_cc-pvtz +%%DATADIR%%/libraries/nlo-v +%%DATADIR%%/libraries/nmr-dkh_tz2p +%%DATADIR%%/libraries/partridge_uncontracted_1 +%%DATADIR%%/libraries/partridge_uncontracted_2 +%%DATADIR%%/libraries/partridge_uncontracted_3 +%%DATADIR%%/libraries/partridge_uncontracted_4 +%%DATADIR%%/libraries/pc-0 +%%DATADIR%%/libraries/pc-1 +%%DATADIR%%/libraries/pc-2 +%%DATADIR%%/libraries/pc-3 +%%DATADIR%%/libraries/pc-4 +%%DATADIR%%/libraries/pcemd-2 +%%DATADIR%%/libraries/pcemd-3 +%%DATADIR%%/libraries/pcemd-4 +%%DATADIR%%/libraries/pcj-0 +%%DATADIR%%/libraries/pcj-0_2006 +%%DATADIR%%/libraries/pcj-1 +%%DATADIR%%/libraries/pcj-1_2006 +%%DATADIR%%/libraries/pcj-2 +%%DATADIR%%/libraries/pcj-2_2006 +%%DATADIR%%/libraries/pcj-3 +%%DATADIR%%/libraries/pcj-3_2006 +%%DATADIR%%/libraries/pcj-4 +%%DATADIR%%/libraries/pcj-4_2006 +%%DATADIR%%/libraries/pcs-0 +%%DATADIR%%/libraries/pcs-1 +%%DATADIR%%/libraries/pcs-2 +%%DATADIR%%/libraries/pcs-3 +%%DATADIR%%/libraries/pcs-4 +%%DATADIR%%/libraries/pcseg-0 +%%DATADIR%%/libraries/pcseg-1 +%%DATADIR%%/libraries/pcseg-2 +%%DATADIR%%/libraries/pcseg-3 *** DIFF OUTPUT TRUNCATED AT 1000 LINES ***