ESP-A1 project. RESP input generated by R.E.D. &cntrl ioutopt=1, iqopt=1, nmol=24, ihfree=1, irstrnt=1, qwt= 0.0000 &end 1.0 C3'endo_Adenosine 0 32 Column not used by RESP (Added by R.E.D. for information) 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 7 0 19 1 0 20 1 20 21 6 0 22 6 0 23 7 0 24 6 0 25 1 0 26 7 0 27 6 0 28 7 0 29 6 0 30 1 0 31 7 0 32 1.0 C3'endo_Adenosine 0 32 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 7 0 19 1 0 20 1 20 21 6 0 22 6 0 23 7 0 24 6 0 25 1 0 26 7 0 27 6 0 28 7 0 29 6 0 30 1 0 31 7 0 32 1.0 C3'endo_Adenosine 0 32 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 7 0 19 1 0 20 1 20 21 6 0 22 6 0 23 7 0 24 6 0 25 1 0 26 7 0 27 6 0 28 7 0 29 6 0 30 1 0 31 7 0 32 1.0 C3'endo_Adenosine 0 32 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 7 0 19 1 0 20 1 20 21 6 0 22 6 0 23 7 0 24 6 0 25 1 0 26 7 0 27 6 0 28 7 0 29 6 0 30 1 0 31 7 0 32 1.0 C3'endo_Adenosine 0 32 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 7 0 19 1 0 20 1 20 21 6 0 22 6 0 23 7 0 24 6 0 25 1 0 26 7 0 27 6 0 28 7 0 29 6 0 30 1 0 31 7 0 32 1.0 C3'endo_Adenosine 0 32 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 7 0 19 1 0 20 1 20 21 6 0 22 6 0 23 7 0 24 6 0 25 1 0 26 7 0 27 6 0 28 7 0 29 6 0 30 1 0 31 7 0 32 1.0 C3'endo_Cytidine 0 30 Column not used by RESP (Added by R.E.D. for information) 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 7 0 19 1 0 20 1 20 21 6 0 22 7 0 23 6 0 24 8 0 25 7 0 26 6 0 27 1 0 28 6 0 29 1 0 30 1.0 C3'endo_Cytidine 0 30 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 7 0 19 1 0 20 1 20 21 6 0 22 7 0 23 6 0 24 8 0 25 7 0 26 6 0 27 1 0 28 6 0 29 1 0 30 1.0 C3'endo_Cytidine 0 30 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 7 0 19 1 0 20 1 20 21 6 0 22 7 0 23 6 0 24 8 0 25 7 0 26 6 0 27 1 0 28 6 0 29 1 0 30 1.0 C3'endo_Cytidine 0 30 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 7 0 19 1 0 20 1 20 21 6 0 22 7 0 23 6 0 24 8 0 25 7 0 26 6 0 27 1 0 28 6 0 29 1 0 30 1.0 C3'endo_Cytidine 0 30 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 7 0 19 1 0 20 1 20 21 6 0 22 7 0 23 6 0 24 8 0 25 7 0 26 6 0 27 1 0 28 6 0 29 1 0 30 1.0 C3'endo_Cytidine 0 30 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 7 0 19 1 0 20 1 20 21 6 0 22 7 0 23 6 0 24 8 0 25 7 0 26 6 0 27 1 0 28 6 0 29 1 0 30 1.0 C3'endo_Guanosine 0 33 Column not used by RESP (Added by R.E.D. for information) 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 7 0 19 1 0 20 1 20 21 8 0 22 6 0 23 6 0 24 7 0 25 6 0 26 1 0 27 7 0 28 6 0 29 7 0 30 6 0 31 7 0 32 1 0 33 1.0 C3'endo_Guanosine 0 33 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 7 0 19 1 0 20 1 20 21 8 0 22 6 0 23 6 0 24 7 0 25 6 0 26 1 0 27 7 0 28 6 0 29 7 0 30 6 0 31 7 0 32 1 0 33 1.0 C3'endo_Guanosine 0 33 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 7 0 19 1 0 20 1 20 21 8 0 22 6 0 23 6 0 24 7 0 25 6 0 26 1 0 27 7 0 28 6 0 29 7 0 30 6 0 31 7 0 32 1 0 33 1.0 C3'endo_Guanosine 0 33 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 7 0 19 1 0 20 1 20 21 8 0 22 6 0 23 6 0 24 7 0 25 6 0 26 1 0 27 7 0 28 6 0 29 7 0 30 6 0 31 7 0 32 1 0 33 1.0 C3'endo_Guanosine 0 33 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 7 0 19 1 0 20 1 20 21 8 0 22 6 0 23 6 0 24 7 0 25 6 0 26 1 0 27 7 0 28 6 0 29 7 0 30 6 0 31 7 0 32 1 0 33 1.0 C3'endo_Guanosine 0 33 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 7 0 19 1 0 20 1 20 21 8 0 22 6 0 23 6 0 24 7 0 25 6 0 26 1 0 27 7 0 28 6 0 29 7 0 30 6 0 31 7 0 32 1 0 33 1.0 C3'endo_Uridine 0 29 Column not used by RESP (Added by R.E.D. for information) 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 8 0 19 6 0 20 7 0 21 1 0 22 6 0 23 8 0 24 7 0 25 6 0 26 1 0 27 6 0 28 1 0 29 1.0 C3'endo_Uridine 0 29 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 8 0 19 6 0 20 7 0 21 1 0 22 6 0 23 8 0 24 7 0 25 6 0 26 1 0 27 6 0 28 1 0 29 1.0 C3'endo_Uridine 0 29 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 8 0 19 6 0 20 7 0 21 1 0 22 6 0 23 8 0 24 7 0 25 6 0 26 1 0 27 6 0 28 1 0 29 1.0 C3'endo_Uridine 0 29 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 8 0 19 6 0 20 7 0 21 1 0 22 6 0 23 8 0 24 7 0 25 6 0 26 1 0 27 6 0 28 1 0 29 1.0 C3'endo_Uridine 0 29 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 8 0 19 6 0 20 7 0 21 1 0 22 6 0 23 8 0 24 7 0 25 6 0 26 1 0 27 6 0 28 1 0 29 1.0 C3'endo_Uridine 0 29 8 0 1 1 0 2 8 0 3 1 0 4 6 0 5 1 0 6 6 0 7 1 0 8 6 0 9 1 0 10 6 0 11 1 0 12 6 0 13 1 0 14 1 14 15 8 0 16 8 0 17 1 0 18 8 0 19 6 0 20 7 0 21 1 0 22 6 0 23 8 0 24 7 0 25 6 0 26 1 0 27 6 0 28 1 0 29 Inter-'molecular' charge equivalencing (i.e. for different orientations or conformations) 6 1 1 2 1 3 1 4 1 5 1 6 1 6 1 2 2 2 3 2 4 2 5 2 6 2 6 1 3 2 3 3 3 4 3 5 3 6 3 6 1 4 2 4 3 4 4 4 5 4 6 4 6 1 5 2 5 3 5 4 5 5 5 6 5 6 1 6 2 6 3 6 4 6 5 6 6 6 6 1 7 2 7 3 7 4 7 5 7 6 7 6 1 8 2 8 3 8 4 8 5 8 6 8 6 1 9 2 9 3 9 4 9 5 9 6 9 6 1 10 2 10 3 10 4 10 5 10 6 10 6 1 11 2 11 3 11 4 11 5 11 6 11 6 1 12 2 12 3 12 4 12 5 12 6 12 6 1 13 2 13 3 13 4 13 5 13 6 13 6 1 14 2 14 3 14 4 14 5 14 6 14 6 1 16 2 16 3 16 4 16 5 16 6 16 6 1 17 2 17 3 17 4 17 5 17 6 17 6 1 18 2 18 3 18 4 18 5 18 6 18 6 1 19 2 19 3 19 4 19 5 19 6 19 6 1 20 2 20 3 20 4 20 5 20 6 20 6 1 22 2 22 3 22 4 22 5 22 6 22 6 1 23 2 23 3 23 4 23 5 23 6 23 6 1 24 2 24 3 24 4 24 5 24 6 24 6 1 25 2 25 3 25 4 25 5 25 6 25 6 1 26 2 26 3 26 4 26 5 26 6 26 6 1 27 2 27 3 27 4 27 5 27 6 27 6 1 28 2 28 3 28 4 28 5 28 6 28 6 1 29 2 29 3 29 4 29 5 29 6 29 6 1 30 2 30 3 30 4 30 5 30 6 30 6 1 31 2 31 3 31 4 31 5 31 6 31 6 1 32 2 32 3 32 4 32 5 32 6 32 6 7 1 8 1 9 1 10 1 11 1 12 1 6 7 2 8 2 9 2 10 2 11 2 12 2 6 7 3 8 3 9 3 10 3 11 3 12 3 6 7 4 8 4 9 4 10 4 11 4 12 4 6 7 5 8 5 9 5 10 5 11 5 12 5 6 7 6 8 6 9 6 10 6 11 6 12 6 6 7 7 8 7 9 7 10 7 11 7 12 7 6 7 8 8 8 9 8 10 8 11 8 12 8 6 7 9 8 9 9 9 10 9 11 9 12 9 6 7 10 8 10 9 10 10 10 11 10 12 10 6 7 11 8 11 9 11 10 11 11 11 12 11 6 7 12 8 12 9 12 10 12 11 12 12 12 6 7 13 8 13 9 13 10 13 11 13 12 13 6 7 14 8 14 9 14 10 14 11 14 12 14 6 7 16 8 16 9 16 10 16 11 16 12 16 6 7 17 8 17 9 17 10 17 11 17 12 17 6 7 18 8 18 9 18 10 18 11 18 12 18 6 7 19 8 19 9 19 10 19 11 19 12 19 6 7 20 8 20 9 20 10 20 11 20 12 20 6 7 22 8 22 9 22 10 22 11 22 12 22 6 7 23 8 23 9 23 10 23 11 23 12 23 6 7 24 8 24 9 24 10 24 11 24 12 24 6 7 25 8 25 9 25 10 25 11 25 12 25 6 7 26 8 26 9 26 10 26 11 26 12 26 6 7 27 8 27 9 27 10 27 11 27 12 27 6 7 28 8 28 9 28 10 28 11 28 12 28 6 7 29 8 29 9 29 10 29 11 29 12 29 6 7 30 8 30 9 30 10 30 11 30 12 30 6 13 1 14 1 15 1 16 1 17 1 18 1 6 13 2 14 2 15 2 16 2 17 2 18 2 6 13 3 14 3 15 3 16 3 17 3 18 3 6 13 4 14 4 15 4 16 4 17 4 18 4 6 13 5 14 5 15 5 16 5 17 5 18 5 6 13 6 14 6 15 6 16 6 17 6 18 6 6 13 7 14 7 15 7 16 7 17 7 18 7 6 13 8 14 8 15 8 16 8 17 8 18 8 6 13 9 14 9 15 9 16 9 17 9 18 9 6 13 10 14 10 15 10 16 10 17 10 18 10 6 13 11 14 11 15 11 16 11 17 11 18 11 6 13 12 14 12 15 12 16 12 17 12 18 12 6 13 13 14 13 15 13 16 13 17 13 18 13 6 13 14 14 14 15 14 16 14 17 14 18 14 6 13 16 14 16 15 16 16 16 17 16 18 16 6 13 17 14 17 15 17 16 17 17 17 18 17 6 13 18 14 18 15 18 16 18 17 18 18 18 6 13 19 14 19 15 19 16 19 17 19 18 19 6 13 20 14 20 15 20 16 20 17 20 18 20 6 13 22 14 22 15 22 16 22 17 22 18 22 6 13 23 14 23 15 23 16 23 17 23 18 23 6 13 24 14 24 15 24 16 24 17 24 18 24 6 13 25 14 25 15 25 16 25 17 25 18 25 6 13 26 14 26 15 26 16 26 17 26 18 26 6 13 27 14 27 15 27 16 27 17 27 18 27 6 13 28 14 28 15 28 16 28 17 28 18 28 6 13 29 14 29 15 29 16 29 17 29 18 29 6 13 30 14 30 15 30 16 30 17 30 18 30 6 13 31 14 31 15 31 16 31 17 31 18 31 6 13 32 14 32 15 32 16 32 17 32 18 32 6 13 33 14 33 15 33 16 33 17 33 18 33 6 19 1 20 1 21 1 22 1 23 1 24 1 6 19 2 20 2 21 2 22 2 23 2 24 2 6 19 3 20 3 21 3 22 3 23 3 24 3 6 19 4 20 4 21 4 22 4 23 4 24 4 6 19 5 20 5 21 5 22 5 23 5 24 5 6 19 6 20 6 21 6 22 6 23 6 24 6 6 19 7 20 7 21 7 22 7 23 7 24 7 6 19 8 20 8 21 8 22 8 23 8 24 8 6 19 9 20 9 21 9 22 9 23 9 24 9 6 19 10 20 10 21 10 22 10 23 10 24 10 6 19 11 20 11 21 11 22 11 23 11 24 11 6 19 12 20 12 21 12 22 12 23 12 24 12 6 19 13 20 13 21 13 22 13 23 13 24 13 6 19 14 20 14 21 14 22 14 23 14 24 14 6 19 16 20 16 21 16 22 16 23 16 24 16 6 19 17 20 17 21 17 22 17 23 17 24 17 6 19 18 20 18 21 18 22 18 23 18 24 18 6 19 19 20 19 21 19 22 19 23 19 24 19 6 19 20 20 20 21 20 22 20 23 20 24 20 6 19 21 20 21 21 21 22 21 23 21 24 21 6 19 22 20 22 21 22 22 22 23 22 24 22 6 19 23 20 23 21 23 22 23 23 23 24 23 6 19 24 20 24 21 24 22 24 23 24 24 24 6 19 25 20 25 21 25 22 25 23 25 24 25 6 19 26 20 26 21 26 22 26 23 26 24 26 6 19 27 20 27 21 27 22 27 23 27 24 27 6 19 28 20 28 21 28 22 28 23 28 24 28 6 19 29 20 29 21 29 22 29 23 29 24 29 4 Inter-'molecular' charge equivalencing (i.e. for different molecules) 1 1 7 1 13 1 19 1 4 1 2 7 2 13 2 19 2 4 1 3 7 3 13 3 19 3 4 1 4 7 4 13 4 19 4 4 1 7 7 7 13 7 19 7 4 1 8 7 8 13 8 19 8 4 1 9 7 9 13 9 19 9 4 1 10 7 10 13 10 19 10 4 1 11 7 11 13 11 19 11 4 1 12 7 12 13 12 19 12 4 1 13 7 13 13 13 19 13 4 1 14 7 14 13 14 19 14 4 1 15 7 15 13 15 19 15 4 1 16 7 16 13 16 19 16 4 1 17 7 17 13 17 19 17 4 1 18 7 18 13 18 19 18