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grid_points_am1d.dat
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grid_points_am1d.dat
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# Table S1: Grid points of correction profiles (MP2-AM1d-PhoT)
# Zx Zy dA dC dG dT rA rC rG rU
-60.0 -60.0 -22.3 -23.0 -21.5 -22.6 -19.9 -20.3 -19.6 -19.9
-60.0 -54.0 -20.8 -21.4 -20.2 -21.2 -17.7 -17.6 -17.4 -17.4
-60.0 -48.0 -19.3 -19.8 -18.8 -19.7 -15.4 -15.0 -15.3 -14.9
-60.0 -42.0 -18.0 -18.4 -17.6 -18.3 -13.5 -12.8 -13.4 -12.8
-60.0 -36.0 -17.0 -17.3 -16.6 -17.1 -12.0 -11.0 -11.9 -11.1
-60.0 -30.0 -16.2 -16.5 -15.9 -16.2 -10.7 -9.6 -10.7 -9.7
-60.0 -24.0 -15.7 -15.9 -15.4 -15.7 -9.8 -8.6 -9.8 -8.8
-60.0 -18.0 -15.3 -15.6 -15.1 -15.3 -9.1 -7.8 -9.2 -8.1
-60.0 -12.0 -14.9 -15.3 -14.8 -15.0 -8.7 -7.4 -8.8 -7.8
-60.0 -6.0 -14.8 -15.2 -14.7 -14.9 -8.5 -7.3 -8.7 -7.8
-60.0 0.0 -14.8 -15.2 -14.8 -14.9 -8.6 -7.5 -8.8 -8.0
-60.0 6.0 -15.0 -15.3 -15.0 -15.1 -8.9 -7.9 -9.1 -8.5
-60.0 12.0 -15.4 -15.7 -15.4 -15.5 -9.4 -8.6 -9.6 -9.2
-60.0 18.0 -15.9 -16.2 -16.0 -16.0 -10.1 -9.4 -10.4 -10.1
-60.0 24.0 -16.6 -17.0 -16.7 -16.7 -11.0 -10.4 -11.3 -11.1
-60.0 30.0 -17.5 -17.9 -17.6 -17.7 -12.1 -11.7 -12.4 -12.3
-60.0 36.0 -18.6 -19.1 -18.7 -18.8 -13.4 -13.1 -13.8 -13.8
-60.0 42.0 -20.0 -20.6 -20.1 -20.3 -15.0 -14.8 -15.4 -15.4
-60.0 48.0 -21.7 -22.3 -21.8 -22.0 -16.8 -16.8 -17.3 -17.4
-60.0 54.0 -23.7 -24.3 -23.8 -24.0 -18.9 -18.9 -19.4 -19.6
-60.0 60.0 -26.0 -26.5 -26.0 -26.2 -21.2 -21.3 -21.7 -21.9
-54.0 -60.0 -21.5 -22.0 -20.8 -21.8 -19.9 -20.2 -19.7 -19.9
-54.0 -54.0 -19.6 -19.9 -18.9 -19.8 -17.1 -17.0 -16.9 -16.9
-54.0 -48.0 -17.9 -18.2 -17.3 -18.0 -14.7 -14.3 -14.5 -14.2
-54.0 -42.0 -16.5 -16.7 -16.0 -16.6 -12.7 -12.0 -12.5 -12.0
-54.0 -36.0 -15.4 -15.6 -15.0 -15.4 -11.1 -10.2 -11.0 -10.3
-54.0 -30.0 -14.6 -14.7 -14.2 -14.5 -9.9 -8.8 -9.8 -8.9
-54.0 -24.0 -14.0 -14.1 -13.7 -13.9 -8.9 -7.6 -8.8 -7.8
-54.0 -18.0 -13.6 -13.8 -13.4 -13.5 -8.1 -6.8 -8.1 -7.0
-54.0 -12.0 -13.3 -13.5 -13.1 -13.3 -7.6 -6.3 -7.7 -6.6
-54.0 -6.0 -13.1 -13.5 -13.1 -13.3 -7.4 -6.0 -7.5 -6.4
-54.0 0.0 -13.2 -13.5 -13.2 -13.3 -7.4 -6.2 -7.6 -6.6
-54.0 6.0 -13.5 -13.8 -13.5 -13.6 -7.7 -6.6 -7.9 -7.1
-54.0 12.0 -13.9 -14.2 -13.9 -14.0 -8.2 -7.2 -8.4 -7.9
-54.0 18.0 -14.5 -14.8 -14.6 -14.6 -8.9 -8.1 -9.2 -8.8
-54.0 24.0 -15.2 -15.5 -15.3 -15.3 -9.8 -9.2 -10.1 -9.9
-54.0 30.0 -16.1 -16.4 -16.2 -16.2 -10.9 -10.4 -11.2 -11.1
-54.0 36.0 -17.2 -17.6 -17.3 -17.3 -12.1 -11.7 -12.5 -12.4
-54.0 42.0 -18.5 -18.9 -18.6 -18.7 -13.5 -13.3 -13.9 -14.0
-54.0 48.0 -20.1 -20.5 -20.2 -20.3 -15.2 -15.1 -15.7 -15.8
-54.0 54.0 -22.0 -22.5 -22.1 -22.2 -17.2 -17.2 -17.7 -17.9
-54.0 60.0 -24.2 -24.7 -24.3 -24.4 -19.4 -19.5 -19.9 -20.2
-48.0 -60.0 -20.5 -20.9 -19.7 -20.6 -19.5 -19.8 -19.3 -19.7
-48.0 -54.0 -18.4 -18.6 -17.7 -18.4 -16.5 -16.5 -16.3 -16.4
-48.0 -48.0 -16.6 -16.8 -16.0 -16.6 -14.0 -13.8 -13.8 -13.7
-48.0 -42.0 -15.2 -15.2 -14.6 -15.2 -12.0 -11.5 -11.8 -11.5
-48.0 -36.0 -14.0 -14.0 -13.5 -13.9 -10.4 -9.7 -10.2 -9.7
-48.0 -30.0 -13.1 -13.1 -12.7 -12.9 -9.2 -8.2 -9.0 -8.2
-48.0 -24.0 -12.4 -12.5 -12.1 -12.2 -8.2 -7.0 -8.1 -7.1
-48.0 -18.0 -12.0 -12.1 -11.7 -11.8 -7.4 -6.0 -7.3 -6.2
-48.0 -12.0 -11.7 -11.9 -11.6 -11.7 -6.8 -5.4 -6.8 -5.7
-48.0 -6.0 -11.6 -11.9 -11.5 -11.7 -6.5 -5.1 -6.6 -5.4
-48.0 0.0 -11.7 -12.0 -11.6 -11.8 -6.5 -5.1 -6.6 -5.5
-48.0 6.0 -11.9 -12.2 -11.9 -12.1 -6.7 -5.4 -6.8 -5.9
-48.0 12.0 -12.4 -12.7 -12.5 -12.5 -7.2 -6.0 -7.3 -6.6
-48.0 18.0 -13.0 -13.3 -13.1 -13.1 -7.8 -6.8 -8.1 -7.5
-48.0 24.0 -13.8 -14.0 -13.9 -13.9 -8.7 -7.9 -8.9 -8.6
-48.0 30.0 -14.7 -14.9 -14.8 -14.8 -9.7 -9.1 -10.0 -9.8
-48.0 36.0 -15.7 -16.0 -15.9 -15.8 -10.8 -10.4 -11.2 -11.1
-48.0 42.0 -17.0 -17.3 -17.1 -17.1 -12.1 -11.9 -12.6 -12.6
-48.0 48.0 -18.5 -18.9 -18.7 -18.7 -13.7 -13.6 -14.2 -14.3
-48.0 54.0 -20.4 -20.8 -20.5 -20.5 -15.6 -15.6 -16.0 -16.3
-48.0 60.0 -22.5 -23.0 -22.7 -22.7 -17.7 -17.8 -18.2 -18.5
-42.0 -60.0 -19.4 -19.7 -18.6 -19.4 -19.0 -19.5 -18.8 -19.4
-42.0 -54.0 -17.3 -17.3 -16.6 -17.1 -16.0 -16.1 -15.7 -16.1
-42.0 -48.0 -15.5 -15.4 -14.8 -15.3 -13.4 -13.4 -13.2 -13.4
-42.0 -42.0 -14.0 -13.8 -13.4 -13.8 -11.4 -11.1 -11.2 -11.1
-42.0 -36.0 -12.7 -12.6 -12.2 -12.4 -9.8 -9.2 -9.6 -9.3
-42.0 -30.0 -11.7 -11.6 -11.3 -11.4 -8.6 -7.7 -8.4 -7.8
-42.0 -24.0 -11.0 -10.9 -10.6 -10.7 -7.6 -6.5 -7.4 -6.6
-42.0 -18.0 -10.5 -10.4 -10.2 -10.2 -6.8 -5.5 -6.6 -5.6
-42.0 -12.0 -10.2 -10.3 -10.0 -10.1 -6.2 -4.7 -6.1 -4.9
-42.0 -6.0 -10.1 -10.3 -10.0 -10.1 -5.8 -4.3 -5.8 -4.6
-42.0 0.0 -10.1 -10.4 -10.1 -10.3 -5.6 -4.1 -5.7 -4.5
-42.0 6.0 -10.4 -10.7 -10.4 -10.6 -5.7 -4.3 -5.9 -4.8
-42.0 12.0 -10.8 -11.1 -10.9 -11.0 -6.1 -4.8 -6.3 -5.3
-42.0 18.0 -11.4 -11.6 -11.5 -11.5 -6.7 -5.5 -6.9 -6.1
-42.0 24.0 -12.2 -12.4 -12.3 -12.3 -7.4 -6.5 -7.7 -7.2
-42.0 30.0 -13.1 -13.3 -13.2 -13.1 -8.4 -7.6 -8.7 -8.3
-42.0 36.0 -14.2 -14.3 -14.3 -14.2 -9.5 -8.9 -9.8 -9.7
-42.0 42.0 -15.4 -15.7 -15.6 -15.5 -10.8 -10.4 -11.2 -11.2
-42.0 48.0 -17.0 -17.2 -17.1 -17.1 -12.3 -12.1 -12.7 -12.8
-42.0 54.0 -18.8 -19.1 -19.0 -18.9 -14.0 -14.0 -14.5 -14.8
-42.0 60.0 -20.9 -21.3 -21.1 -21.1 -16.1 -16.2 -16.6 -16.9
-36.0 -60.0 -18.1 -18.2 -17.4 -17.8 -18.5 -19.1 -18.2 -19.0
-36.0 -54.0 -16.1 -15.9 -15.3 -15.7 -15.3 -15.7 -15.1 -15.7
-36.0 -48.0 -14.3 -14.0 -13.6 -13.8 -12.8 -13.0 -12.5 -13.0
-36.0 -42.0 -12.7 -12.4 -12.1 -12.3 -10.8 -10.7 -10.5 -10.8
-36.0 -36.0 -11.4 -11.0 -10.9 -10.9 -9.2 -8.8 -8.9 -8.9
-36.0 -30.0 -10.3 -10.0 -9.9 -9.8 -7.9 -7.3 -7.7 -7.4
-36.0 -24.0 -9.5 -9.2 -9.1 -9.0 -6.9 -6.0 -6.7 -6.1
-36.0 -18.0 -8.9 -8.7 -8.7 -8.5 -6.1 -4.9 -6.0 -5.1
-36.0 -12.0 -8.6 -8.5 -8.5 -8.4 -5.5 -4.1 -5.4 -4.3
-36.0 -6.0 -8.5 -8.6 -8.4 -8.4 -5.1 -3.6 -5.0 -3.8
-36.0 0.0 -8.5 -8.7 -8.5 -8.6 -4.8 -3.3 -4.9 -3.6
-36.0 6.0 -8.7 -9.0 -8.7 -8.9 -4.8 -3.3 -4.9 -3.7
-36.0 12.0 -9.1 -9.4 -9.2 -9.3 -5.0 -3.6 -5.2 -4.1
-36.0 18.0 -9.7 -9.9 -9.8 -9.8 -5.5 -4.1 -5.7 -4.7
-36.0 24.0 -10.4 -10.6 -10.6 -10.5 -6.2 -5.0 -6.4 -5.7
-36.0 30.0 -11.4 -11.5 -11.6 -11.4 -7.0 -6.1 -7.3 -6.8
-36.0 36.0 -12.5 -12.7 -12.7 -12.6 -8.1 -7.4 -8.4 -8.1
-36.0 42.0 -13.9 -14.0 -14.1 -13.9 -9.4 -8.9 -9.7 -9.6
-36.0 48.0 -15.5 -15.6 -15.7 -15.5 -10.9 -10.6 -11.3 -11.4
-36.0 54.0 -17.3 -17.5 -17.5 -17.4 -12.6 -12.5 -13.1 -13.3
-36.0 60.0 -19.4 -19.6 -19.6 -19.5 -14.6 -14.7 -15.1 -15.4
-30.0 -60.0 -16.5 -16.2 -15.8 -15.9 -17.8 -18.6 -17.6 -18.5
-30.0 -54.0 -14.5 -14.1 -13.8 -13.9 -14.6 -15.2 -14.3 -15.2
-30.0 -48.0 -12.8 -12.3 -12.1 -12.1 -12.0 -12.4 -11.8 -12.5
-30.0 -42.0 -11.3 -10.7 -10.7 -10.6 -10.0 -10.2 -9.7 -10.3
-30.0 -36.0 -9.9 -9.3 -9.4 -9.3 -8.4 -8.3 -8.1 -8.4
-30.0 -30.0 -8.8 -8.2 -8.4 -8.1 -7.1 -6.7 -6.9 -6.8
-30.0 -24.0 -7.9 -7.4 -7.6 -7.3 -6.1 -5.5 -5.9 -5.6
-30.0 -18.0 -7.3 -6.9 -7.0 -6.8 -5.4 -4.4 -5.2 -4.5
-30.0 -12.0 -7.0 -6.7 -6.8 -6.6 -4.8 -3.5 -4.6 -3.7
-30.0 -6.0 -6.8 -6.8 -6.7 -6.6 -4.3 -2.9 -4.2 -3.1
-30.0 0.0 -6.8 -6.9 -6.8 -6.8 -4.0 -2.5 -4.0 -2.8
-30.0 6.0 -7.0 -7.2 -7.0 -7.1 -3.9 -2.4 -4.0 -2.7
-30.0 12.0 -7.3 -7.6 -7.4 -7.5 -4.0 -2.5 -4.2 -2.9
-30.0 18.0 -7.9 -8.1 -8.0 -8.1 -4.4 -2.9 -4.6 -3.4
-30.0 24.0 -8.7 -8.8 -8.9 -8.8 -5.0 -3.6 -5.2 -4.2
-30.0 30.0 -9.7 -9.8 -9.9 -9.8 -5.8 -4.6 -6.1 -5.3
-30.0 36.0 -10.9 -11.0 -11.2 -10.9 -6.8 -5.9 -7.1 -6.6
-30.0 42.0 -12.4 -12.5 -12.6 -12.4 -8.1 -7.5 -8.4 -8.2
-30.0 48.0 -14.1 -14.1 -14.3 -14.0 -9.6 -9.2 -10.0 -10.0
-30.0 54.0 -16.0 -16.1 -16.2 -16.0 -11.4 -11.2 -11.8 -11.9
-30.0 60.0 -18.1 -18.2 -18.3 -18.1 -13.4 -13.3 -13.8 -14.1
-24.0 -60.0 -14.3 -14.7 -13.6 -14.3 -17.0 -17.8 -16.7 -17.9
-24.0 -54.0 -12.4 -12.3 -11.8 -12.1 -13.7 -14.4 -13.5 -14.5
-24.0 -48.0 -11.1 -10.4 -10.4 -10.3 -11.1 -11.7 -10.9 -11.8
-24.0 -42.0 -9.7 -8.9 -9.1 -8.8 -9.1 -9.5 -8.8 -9.6
-24.0 -36.0 -8.3 -7.6 -7.8 -7.5 -7.5 -7.6 -7.2 -7.8
-24.0 -30.0 -7.2 -6.4 -6.7 -6.3 -6.2 -6.1 -6.0 -6.2
-24.0 -24.0 -6.2 -5.6 -5.9 -5.5 -5.3 -4.8 -5.1 -5.0
-24.0 -18.0 -5.6 -5.1 -5.3 -4.9 -4.5 -3.7 -4.3 -3.9
-24.0 -12.0 -5.2 -4.9 -5.1 -4.7 -3.9 -2.8 -3.8 -3.0
-24.0 -6.0 -5.1 -4.9 -5.0 -4.8 -3.4 -2.1 -3.4 -2.3
-24.0 0.0 -5.1 -5.2 -5.1 -5.1 -3.1 -1.7 -3.1 -1.9
-24.0 6.0 -5.2 -5.4 -5.3 -5.4 -3.0 -1.5 -3.0 -1.8
-24.0 12.0 -5.6 -5.8 -5.6 -5.8 -3.1 -1.6 -3.2 -2.0
-24.0 18.0 -6.1 -6.4 -6.3 -6.4 -3.4 -1.9 -3.6 -2.4
-24.0 24.0 -7.0 -7.2 -7.2 -7.2 -3.9 -2.5 -4.2 -3.0
-24.0 30.0 -8.2 -8.3 -8.4 -8.2 -4.7 -3.4 -5.0 -4.0
-24.0 36.0 -9.5 -9.6 -9.7 -9.5 -5.7 -4.6 -6.0 -5.3
-24.0 42.0 -11.1 -11.1 -11.3 -11.0 -7.0 -6.2 -7.3 -6.9
-24.0 48.0 -12.9 -12.9 -13.1 -12.8 -8.6 -8.0 -8.9 -8.7
-24.0 54.0 -14.8 -14.8 -15.1 -14.7 -10.3 -10.0 -10.7 -10.7
-24.0 60.0 -17.0 -16.9 -17.2 -16.9 -12.3 -12.1 -12.7 -12.9
-18.0 -60.0 -12.9 -13.7 -12.4 -13.6 -15.9 -16.8 -15.7 -16.9
-18.0 -54.0 -11.0 -11.1 -10.4 -11.0 -12.6 -13.4 -12.4 -13.5
-18.0 -48.0 -9.4 -8.9 -8.8 -8.9 -10.0 -10.7 -9.8 -10.8
-18.0 -42.0 -8.0 -7.2 -7.5 -7.1 -8.0 -8.5 -7.8 -8.7
-18.0 -36.0 -6.7 -5.9 -6.2 -5.8 -6.4 -6.8 -6.2 -6.9
-18.0 -30.0 -5.5 -4.7 -5.1 -4.7 -5.2 -5.3 -5.0 -5.5
-18.0 -24.0 -4.6 -3.8 -4.2 -3.7 -4.3 -4.1 -4.1 -4.2
-18.0 -18.0 -3.9 -3.3 -3.7 -3.2 -3.5 -3.0 -3.4 -3.2
-18.0 -12.0 -3.5 -3.1 -3.4 -3.0 -2.9 -2.1 -2.8 -2.3
-18.0 -6.0 -3.4 -3.2 -3.3 -3.1 -2.5 -1.4 -2.4 -1.6
-18.0 0.0 -3.4 -3.4 -3.4 -3.4 -2.2 -1.0 -2.2 -1.2
-18.0 6.0 -3.6 -3.8 -3.6 -3.8 -2.1 -0.8 -2.1 -1.0
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