EOS102585
    alatis_output_mol

 17 18  0  0  1  0  0  0  0  0999 V2000
   -3.2750    3.2670   -0.0770 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.9630   -0.8060   -0.7590 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9710   -2.7990    0.0070 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8330    2.7710   -0.0250 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2320    0.7990    0.2310 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6540    1.2050    0.1320 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4450   -1.6140    0.2130 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9380   -0.5640    0.3490 C   0  0  2  0  0  0  0  0  0  0  0  0
   -2.4780   -2.6320    0.0090 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7910    0.4070    0.1980 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7060   -0.8220    0.1430 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6750   -0.9680    0.2380 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6000    0.5840    0.1080 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0300   -1.3460    0.1130 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7280   -3.5760   -0.0820 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7790    1.3330    0.0490 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.8930   -1.5950    0.3060 O   0  0  0  0  0  0  0  0  0  0  0  0
  4  1  1  0  0  0  0
  5  8  1  0  0  0  0
  8  2  1  6  0  0  0
  9  3  1  0  0  0  0
  9 15  2  0  0  0  0
 10  5  1  0  0  0  0
 10  6  1  0  0  0  0
 11  7  2  0  0  0  0
 11 13  1  0  0  0  0
 11 14  1  0  0  0  0
 12  7  1  0  0  0  0
 12 10  2  0  0  0  0
 12 17  1  0  0  0  0
 13  6  2  0  0  0  0
 13 16  1  0  0  0  0
 14  9  1  0  0  0  0
 16  4  1  0  0  0  0
 17  8  1  0  0  0  0
M  END
>  <ID>  (1) 
EOS102585

>  <Supplier>  (1) 
SIA Enamine

>  <Supplier_ID>  (1) 
Z167605168

> <ALATIS_Standard_InChI>
InChI=1S/C13H17NO3/c1-4-16-13-6-10-5-8(2)17-12(10)7-11(13)14-9(3)15/h6-8H,4-5H2,1-3H3,(H,14,15)/t8-/m0/s1

> <ALATIS_Warnings>

> <ALATIS_Errors>

> <ALATIS_Map>
new index	atom name	original index
1	C	17
2	C	15
3	C	14
4	C	16
5	C	10
6	C	8
7	C	5
8	C	11
9	C	9
10	C	3
11	C	2
12	C	1
13	C	7
14	N	6
15	O	12
16	O	13
17	O	4


> <ALATIS_Mixture_Map>

$$$$
