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-rw-r--r--graphics/mcf2graph/mcf_data_base.mcf29
1 files changed, 15 insertions, 14 deletions
diff --git a/graphics/mcf2graph/mcf_data_base.mcf b/graphics/mcf2graph/mcf_data_base.mcf
index 129239e46d..87fabda340 100644
--- a/graphics/mcf2graph/mcf_data_base.mcf
+++ b/graphics/mcf2graph/mcf_data_base.mcf
@@ -1,5 +1,5 @@
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
-% molecular data base file mcf_data_base.mcf by Akira Yamaji 2021.06.06
+% molecular data base file mcf_data_base.mcf by Akira Yamaji 2021.06.13
%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%%
% tag1:var1;tag2:var2;tag3:var3 .....
% first character of line '%' comment out
@@ -699,8 +699,9 @@ Cat:antibiotics;EN:Neospiramycin;MW:698.9;EXA:1
+
<-90,#1,60,60,-60,60,60,-60,60,60,-60,60,60,60,-60,60,-60,&1,##,
{12,14}=dl,2:O,1:/*_,5:/*OH,3://O,10:/*_,6:/*O!>vt,
- @-6,\*,O,!~wb,?6`.7,-5:O,-3:/*N?!,-4:*/_,
- @7,\*,O,0~wb,?6`.7,-5:O,-2:*/N?!,-1:/*OH,-4:*/_,-3:/*OH,@8,\*,!,!!,O
+ @-6,\*,O,!~wb,?6`.7,-5:O,-3:/*N?!`-.5,-4:*/_`-.5,
+ @7,\*,O,0~wb,?6`.7,-5:O,-2:*/N?!`-.5,-1:/*OH`-.5,-4:*/_`.5,-3:/*OH`-.5,
+ @8,\*,!,!!,O
+------------------------------------------------------------------------------
Cat:antibiotics;EN:Emamectine;MW:886.133;EXA:1
+
@@ -708,24 +709,24 @@ Cat:antibiotics;EN:Emamectine;MW:886.133;EXA:1
@5,#1.04,6,//O,-60,O,60~wb,60,-60,60~wf,60,-60,60,60,60,-60,60,##,&7,
{-1,-3,-7}=dl,(-11,-10)=?6[4],@-2,?6,-6=wf,-1=zb,-5=dl,
{-1,-6}:O,-3:*/_,@-2,\,*/_,!2,
- 17:/_,19:/*_,@18,\,O,!,?6`.8,-1:O,-2:*/_,-4:*/O!,
- @-3,\,O,60,?6`.8,-5:O,-4:*/_,-3:/*NH!,-2:*/O!
+ 17:/_,19:/*_,@18,\,O,!,?6`.7,-1:O,-2:*/_`.5,-4:*/O!`-.5,
+ @-3,\,O,60,?6`.7,-5:O,-4:*/_`.5,-3:/*NH!`-.5,-2:*/O!`-.5
+------------------------------------------------------------------------------
Cat:antibiotics;EN:Spinosad;MW:731.968;EXA:1
+
<30,#1,<-120,60,60,-60,60,60,60,-60,60,60,60,-60,&1,##,
5=?5,-1=dl,{-2^60,-3^-35}:/*H,-3=?6,-4=dl,
{-1^35}:*/H,{-2^-60}:/*H,-2=?5,2:O,{3^25,7^-25}://O,1:/!,
- @-2,\~zf,O,66,?6`.8,-1:O,-2:/_,{-3,-4,-5}:/O!,8~wf:/Me,5^-65~wf:/H,
- @9,\~zf,O,!,|,?6`.8,2:O,3:/_,-3:/N?!
+ @-2,\~zf,O,66,?6`.7,-1:O,-2:/_`.5,{-3,-4,-5}:/O!`-.5,8~wf:/Me`.5,5^-65~wf:/H,
+ @9,\~zf,O,!,|,?6`.7,2:O,3:/_`.5,-3:/N?!`-.5
+------------------------------------------------------------------------------
Cat:antibiotics;EN:Spiramycin;MW:843.1;EXA:1
+
<-90,#1,60,60,-60,60,60,-60,60,60,-60,60,60,60,-60,60,-60,&1,##,
{12,14}=dl,2:O,{1,10^-30}:/*_,5:/*OH,3://O,6:/*O!>vt,
- @-6,\*^-30,O,!~wb,?6`.7,-5:O,-3:/*N?!,-4:*/_,
- @7,\*,O,0~wb,?6`.7,-5:O,-2:*/N?!,-1:/*OH,-4:*/_,
- @-3,\*`1,O,60~wb`1.5,?6`.7,-5:O,{-2^35,-3}:*/OH,{-2^-35,-4}:/*_,
+ @-6,\*^-30,O,!~wb,?6`.7,-5:O,-3:/*N?!`-.5,-4:*/_`.5,
+ @7,\*,O,0~wb,?6`.7,-5:O,-2:*/N?!`-.5,-1:/*OH`-.5,-4:*/_`.5,
+ @-3,\*`1,O,60~wb`1.5,?6`.7,-5:O,{-2^35,-3}:*/OH`-.5,{-2^-35,-4}:/*_`.5,
@8,\*,!,!!,O
+------------------------------------------------------------------------------
Cat:antibiotics;EN:Natamycin;MW:665.733;EXA:1
@@ -734,15 +735,15 @@ Cat:antibiotics;EN:Natamycin;MW:665.733;EXA:1
60,60,-60,60,-60,60,-60,60,60,-60,&1,(12,13)=?6[4],##,
{2,4,6,8,20}=dl,11=zb,23:O,-2:/*OH,-3:*/COOH,
18=?3,-1=wb,-2=wf,-1:O,22://O,24:*/_,{14^60,16}:*/OH,
- @10,*\,O,90,?6`.8,-3:*/OH,-5:/*OH,-4:/*NH2,-1:O,-2:/*_
+ @10,*\,O,90,?6`.7,-3:*/OH`-.5,-5:/*OH`-.5,-4:/*NH2`-.5,-1:O,-2:/*_`.5
+------------------------------------------------------------------------------
Cat:antibiotics;EN:Tylocin;MW:916.10;EXA:1
+
<-90,#1,60,60,-60,60,60,-60,60,60,-60,60,60,60,-60,60,-60,&1,##,
{12,14}=dl,2:O,1:/*!,5:/*OH,3://O,10:/*_,6:/*_,-6://O,-3:/_,
- @-1,*\,-60,O,0~wb,?6`.7,-5:O,-3:/*OH,-4:*/_,{-1,-2}:/*O!,
- @7,\*,O,0~wb,?6`.7,-5:O,-2:*/N?!,-1:/*OH,-4:*/_,
- @-3,\*`1,O,60~wb`1.5,?6`.7,-5:O,{-2^35,-3}:*/OH,{-2^-35,-4}:/*_,
+ @-1,*\,-60,O,0~wb,?6`.7,-5:O,-3:/*OH`-.5,-4:*/_`.5,{-1,-2}:/*O!`-.5,
+ @7,\*,O,0~wb,?6`.7,-5:O,-2:*/N?!`-.5,-1:/*OH`-.5,-4:*/_`.5,
+ @-3,\*`1,O,60~wb`1.5,?6`.7,-5:O,{-2^35,-3}:*/OH`-.5,{-2^-35,-4}:/*_`.5,
@8,\*,!,!!,O
+------------------------------------------------------------------------------
Cat:antibiotics;EN:Tilmicosin;MW:869.133;EXA:1