EOS103065
    alatis_output_mol

 13 13  0  0  1  0  0  0  0  0999 V2000
    3.9030    1.1080   -0.1630 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6110   -2.4370   -0.0330 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8510    0.5620    1.2040 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8270    0.0910   -1.1520 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5530    0.0710    1.3150 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5300   -0.4000   -1.0410 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5410   -0.1390   -0.5070 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4950    0.5740   -0.0300 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5380   -0.9480    0.3310 C   0  0  2  0  0  0  0  0  0  0  0  0
   -0.1180   -0.4160    0.1940 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5100    1.3480   -0.1860 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2380    2.2350   -0.9780 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8440    1.6760    1.0760 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  8  2  0  0  0  0
  4  8  1  0  0  0  0
  5  3  1  0  0  0  0
  6  4  2  0  0  0  0
  7  9  1  0  0  0  0
  8  1  1  0  0  0  0
  9  2  1  6  0  0  0
 10  5  2  0  0  0  0
 10  6  1  0  0  0  0
 10  9  1  0  0  0  0
 11  7  1  0  0  0  0
 11 12  2  0  0  0  0
 11 13  1  0  0  0  0
M  END
>  <ID>  (1) 
EOS103065

>  <Supplier>  (1) 
Specs

>  <Supplier_ID>  (1) 
AE-562/40987650

> <ALATIS_Standard_InChI>
InChI=1S/C11H14O2/c1-8-3-5-10(6-4-8)9(2)7-11(12)13/h3-6,9H,7H2,1-2H3,(H,12,13)/t9-/m1/s1

> <ALATIS_Warnings>

> <ALATIS_Errors>

> <ALATIS_Map>
new index	atom name	original index
1	C	13
2	C	12
3	C	9
4	C	10
5	C	6
6	C	7
7	C	2
8	C	11
9	C	4
10	C	3
11	C	1
12	O	5
13	O	8


> <ALATIS_Mixture_Map>

$$$$
