EOS102995
    alatis_output_mol

 17 17  0  0  0  0  0  0  0  0999 V2000
    5.4010    0.3070    0.8740 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6470    0.9060   -1.4370 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1490    1.5870    0.0110 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9360   -2.5370   -0.0030 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0460   -1.6970    0.0520 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6510   -2.0140    0.1140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5800    0.2170    0.3430 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3800    0.0200   -0.2230 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1820    0.4740   -0.2780 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8610   -0.3200    0.2210 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4780   -0.6350    0.2830 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9830   -0.5050   -0.0860 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0430    0.2560    0.2800 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9510    0.5840    0.3090 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8030   -0.0480    0.4290 N   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4670   -0.4530   -1.0010 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.0920   -1.4850   -0.8090 O   0  0  0  0  0  0  0  0  0  0  0  0
  4  5  1  0  0  0  0
  4  6  2  0  0  0  0
  7 10  1  0  0  0  0
  7 11  2  0  0  0  0
  8  1  1  0  0  0  0
  8  2  1  0  0  0  0
  9  3  1  0  0  0  0
  9 14  1  0  0  0  0
  9 16  2  0  0  0  0
 10  5  2  0  0  0  0
 11  6  1  0  0  0  0
 12 13  1  0  0  0  0
 12 15  1  0  0  0  0
 12 17  2  0  0  0  0
 13  8  1  0  0  0  0
 14 10  1  0  0  0  0
 15 11  1  0  0  0  0
M  END
>  <ID>  (1) 
EOS102995

>  <Supplier>  (1) 
SIA Chemspace

>  <Supplier_ID>  (1) 
CSC000672820

> <ALATIS_Standard_InChI>
InChI=1S/C12H17N3O2/c1-8(2)13-12(17)15-11-6-4-5-10(7-11)14-9(3)16/h4-8H,1-3H3,(H,14,16)(H2,13,15,17)

> <ALATIS_Warnings>

> <ALATIS_Errors>

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


> <ALATIS_Mixture_Map>

$$$$
