# 1 "/opt/topspin2.1/exp/stan/nmr/lists/pp/hcchcogp3d"
;hcchcogp3d
;avance-version (08/06/03)
;HCCH-COSY
;3D sequence with
;   inverse correlation using multiple inept transfer and
;
;      F1(H,t1) -> F2(C,t2) -> F2(C') -> F1(H',t3)
;
;off resonance C=O pulse using shaped pulse
;phase sensitive (t1)
;phase sensitive (t2)
;(use parameterset HCCHCOGP3D)
;
;(L.E. Kay, G.Y. Xu, A.U. Singer, D.R. Muhandiram & J. D. Forman-Kay
;   J. Magn. Reson. B 101, 333 - 337 (1993))
;
;$CLASS=HighRes
;$DIM=3D
;$TYPE=
;$SUBTYPE=
;$COMMENT=


prosol relations=<triple>


# 1 "/opt/topspin2.1/exp/stan/nmr/lists/pp/Avance.incl" 1
;Avance2.incl
;   for 1
;
;avance-version (07/08/21)
;
;$CLASS=HighRes Incl
;$COMMENT=





































































































































;$Id: Avance2.incl,v 1.17.2.1 2007/09/14 16:17:35 ber Exp $
# 27 "/opt/topspin2.1/exp/stan/nmr/lists/pp/hcchcogp3d" 2

# 1 "/opt/topspin2.1/exp/stan/nmr/lists/pp/Grad.incl" 1
;Grad2.incl  -  include file for Gradient Spectroscopy
;   for 1
;
;avance-version (07/01/17)
;
;$CLASS=HighRes Incl
;$COMMENT=



















define list<gradient> EA=<EA>



;$Id: Grad2.incl,v 1.12 2007/01/22 14:22:35 ber Exp $
# 28 "/opt/topspin2.1/exp/stan/nmr/lists/pp/hcchcogp3d" 2

# 1 "/opt/topspin2.1/exp/stan/nmr/lists/pp/Delay.incl" 1
;Delay.incl  -  include file for commonly used delays
;
;version 00/02/07
;
;$CLASS=HighRes Incl
;$COMMENT=


;general delays

define delay DELTA
define delay DELTA1
define delay DELTA2
define delay DELTA3
define delay DELTA4
define delay DELTA5
define delay DELTA6
define delay DELTA7
define delay DELTA8

define delay TAU
define delay TAU1
define delay TAU2
define delay TAU3
define delay TAU4
define delay TAU5


;delays for centering pulses

define delay CEN_HN1
define delay CEN_HN2
define delay CEN_HN3
define delay CEN_HC1
define delay CEN_HC2
define delay CEN_HC3
define delay CEN_HC4
define delay CEN_HP1
define delay CEN_HP2
define delay CEN_CN1
define delay CEN_CN2
define delay CEN_CN3
define delay CEN_CN4
define delay CEN_CP1
define delay CEN_CP2


;loop counters

define loopcounter COUNTER
define loopcounter SCALEF
define loopcounter FACTOR1
define loopcounter FACTOR2
define loopcounter FACTOR3



;$Id: Delay.incl,v 1.12 2005/11/10 12:16:58 ber Exp $
# 29 "/opt/topspin2.1/exp/stan/nmr/lists/pp/hcchcogp3d" 2



"p2=p1*2"
"p4=p3*2"
"p22=p21*2"
"d11=30m"
"d12=20u"

"d4=1.6m"
"d21=1.1m"
"d23=475u"
"d24=3.6m"


"p16=500u"
"p19=2m"
"p29=300u"
"p30=5m"
"p31=4.4m"

"d16=150u"


"d0=3u"
"d10=3u"

"in0=inf1/2"
"in10=inf2/2"


"DELTA1=d4-p16-d16-4u"
"DELTA2=d4-p16-d16-4u+d0*2+p4"
"DELTA3=d23-p29-d16"
"DELTA4=p22+p2+d10*2+4u"
"DELTA5=d24-p29-d16-4u"
"DELTA6=d21-p16-d16-4u"
"DELTA7=d4-p16-d16-p3*2-7u+p1"


"d22=3.6m-d23*2-(in10*td2/4)"


"spoff5=bf2*(cnst21/1000000)-o2"


aqseq 312


# 1 "mc_line 78 file /opt/topspin2.1/exp/stan/nmr/lists/pp/hcchcogp3d expanding definition part of mc command before ze"
; dimension 3 aq-mode (F2) States-TPPI (F1) States-TPPI  F2->F1
define delay MCWRK
define delay MCREST
define loopcounter ST1CNT
"ST1CNT = td2 / (2)"
define loopcounter ST2CNT
"ST2CNT = td1 / (2)"
"MCWRK = 0.125000*d11"
"MCREST = d11 - d11"
    dccorr
# 78 "/opt/topspin2.1/exp/stan/nmr/lists/pp/hcchcogp3d"
1 d11 ze
# 1 "mc_line 78 file /opt/topspin2.1/exp/stan/nmr/lists/pp/hcchcogp3d expanding definition of mc command after ze"
# 79 "/opt/topspin2.1/exp/stan/nmr/lists/pp/hcchcogp3d"
  d11 pl12:f2
# 1 "mc_line 80 file /opt/topspin2.1/exp/stan/nmr/lists/pp/hcchcogp3d expanding start label for mc command"
2 MCWRK  do:f2
LBLSTS2, MCWRK  * 2
LBLF2, MCWRK  * 3
LBLSTS1, MCWRK 
LBLF1, MCWRK 
  MCREST
# 81 "/opt/topspin2.1/exp/stan/nmr/lists/pp/hcchcogp3d"
3 d1
  50u setnmr3|0 setnmr0|34|32|33 ctrlgrad 0
  d12 pl1:f1

  (p1 ph3)
  4u
  p16:gp1
  d16
  DELTA1 pl2:f2
  d0
  (p4 ph1):f2
  d0
  (p2 ph1)
  4u
  p16:gp1
  d16
  DELTA2 pl3:f3
  (p1 ph2)

  p19:gp3
  d16

  (p3 ph4):f2
  d10
  (p22 ph1):f3
  4u
  p29:gp2
  d16
  DELTA3 pl0:f2
  (p14:sp5 ph1):f2
  4u
  p29:gp2
  d16
  DELTA3 pl2:f2
  p2 ph1
  d10
  d22
  (p4 ph1):f2
  DELTA4
  p29:gp2
  d16
  DELTA3
  (p14:sp5 ph1):f2
  4u
  p29:gp2
  d16
  DELTA3 pl2:f2
  d22

  (p3 ph1):f2
  4u
  p29:gp2
  d16
  DELTA5
  (p4 ph1):f2
  4u
  p29:gp2
  d16
  DELTA5 pl10:f1
  (p3 ph2):f2

  (p17 ph1)
  (p17*2 ph2)
  4u
  p30:gp4
  d16 pl1:f1
  (p1 ph1)
  4u
  p31:gp4
  d16

  (p3 ph2):f2
  4u
  p16:gp1
  d16
  DELTA6 pl2:f2
  (center (p2 ph1) (p4 ph1):f2 )
  4u
  p16:gp1
  d16
  DELTA6
  (center (p1 ph1) (p3 ph1):f2 )

  4u
  p16:gp1
  d16
  DELTA1
  (center (p2 ph1) (p4 ph1):f2 )
  4u
  p16:gp1
  d16
  DELTA7 
  (center (p1 ph1) (p3 ph1 3u p3 ph5):f2 )
  4u pl12:f2 
  4u setnmr3^0 setnmr0^34^32^33 ctrlgrad 7
  go=2 ph31 cpd2:f2
# 1 "mc_line 177 file /opt/topspin2.1/exp/stan/nmr/lists/pp/hcchcogp3d expanding mc command in line"
  MCWRK  do:f2 wr #0 if #0 zd ip3
  lo to LBLSTS2 times 2
  MCWRK id0  MCWRK  dp3
  lo to LBLF2 times ST2CNT
  MCWRK rd0  MCWRK  rp3  MCWRK  ip4
  lo to LBLSTS1 times 2
  MCWRK id10
  lo to LBLF1 times ST1CNT
  MCWRK
# 180 "/opt/topspin2.1/exp/stan/nmr/lists/pp/hcchcogp3d"
exit


ph1=0
ph2=1
ph3=0 2
ph4=0 0 2 2
ph5=0 0 0 0 2 2 2 2
ph31=0 2 2 0



;pl0 : 120dB
;pl1 : f1 channel - power level for pulse (default)
;pl2 : f2 channel - power level for pulse (default)
;pl3 : f3 channel - power level for pulse (default)
;pl10: f1 channel - power level for TOCSY-spinlock (trim pulse)
;pl12: f2 channel - power level for CPD/BB decoupling
;sp5: f2 channel - shaped pulse 180 degree   (C=O off resonance)
;p1 : f1 channel -  90 degree high power pulse
;p2 : f1 channel - 180 degree high power pulse
;p3 : f2 channel -  90 degree high power pulse
;p4 : f2 channel - 180 degree high power pulse
;p14: f2 channel - 180 degree shaped pulse
;p16: homospoil/gradient pulse                         [500 usec]
;p17: f1 channel - trim pulse                          [2.5 msec]
;p19: gradient pulse 2                                 [2 msec]
;p22: f3 channel - 180 degree high power pulse
;p29: gradient pulse 3                                 [300 usec]
;p30: gradient pulse 4                                 [5 msec]
;p31: gradient pulse 5                                 [4.4 msec]
;d0 : incremented delay (F1 in 3D)                     [3 usec]
;d4 : 1/(4J(CH)) - tau a                               [1.6 msec]
;d10: incremented delay (F2 in 3D)                     [3 usec]
;d11: delay for disk I/O                               [30 msec]
;d12: delay for power switching                        [20 usec]
;d16: delay for homospoil/gradient recovery
;d21: 1/(6J'(CH)) - tau c                              [1.1 msec]
;d22: d22+d23*2+t2max*0.5 = 1/(4J(CC)) : 3.6m-d23*2-(in10*td2/4)
;d23: tau b                                            [475 usec]
;d24: 1/(4J(CC))                                       [3.6 msec]
;cnst21: CO chemical shift (offset, in ppm)
;cnst23: Caliphatic chemical shift (offset, in ppm)
;o2p: Caliphatic chemical shift (cnst23)
;inf1: 1/SW(Hali) = 2 * DW(Hali)
;inf2: 1/SW(C) = 2 * DW(C)
;in0: 1/(2 * SW(Hali)) = DW(Hali)
;nd0: 2
;in10: 1/(2 * SW(C)) = DW(C)
;nd10: 2
;NS: 16 * n
;DS: 32
;td1: number of experiments in F1
;td2: number of experiments in F2
;FnMODE: States-TPPI in F1 (not suitable for TPPI)
;FnMODE: States-TPPI (or TPPI) in F2
;cpd2: decoupling according to sequence defined by cpdprg2
;pcpd2: f2 channel - 90 degree pulse for decoupling sequence


;use gradient ratio:    gp 1 : gp 2 : gp 3 : gp 4
;                         16 :   16 :   30 :   60

;for z-only gradients:
;gpz1: 16%
;gpz2: 16%
;gpz3: 30%
;gpz4: 60%

;use gradient files:   
;gpnam1: SINE.50
;gpnam2: SINE.50
;gpnam3: SINE.100
;gpnam4: SINE.100



;Processing

;SR(F1): 1/4 SWH(F1)



;$Id: hcchcogp3d,v 1.17.2.1 2008/06/03 13:18:46 ber Exp $