EOS102747
    alatis_output_mol

 17 18  0  0  1  0  0  0  0  0999 V2000
    3.9910   -0.1790    1.4970 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9930   -0.3660   -1.5520 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5220   -1.2570   -0.2450 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2430   -0.7710    0.3750 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9680    1.5850   -0.0140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1170   -0.9710    0.1600 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3920    1.3980   -0.2320 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9980   -1.3620   -0.0380 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8980    0.1750    0.1380 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2860    0.7710    0.5200 C   0  0  2  0  0  0  0  0  0  0  0  0
    1.8000    0.5090    0.2970 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9500    0.1170   -0.1340 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0130    0.8840   -0.7490 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3390   -0.0800   -0.3610 N   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5060    2.0830   -0.9730 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1040    1.5910    1.3780 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4150    1.1280    0.0730 S   0  0  0  0  0  0  0  0  0  0  0  0
  6  4  1  0  0  0  0
  7  5  2  0  0  0  0
  8  3  1  0  0  0  0
  9  3  1  0  0  0  0
 10  1  1  1  0  0  0
 10 13  1  0  0  0  0
 11  4  2  0  0  0  0
 11  5  1  0  0  0  0
 11 10  1  0  0  0  0
 12  6  2  0  0  0  0
 12  7  1  0  0  0  0
 13  2  1  0  0  0  0
 14  8  1  0  0  0  0
 14 12  1  0  0  0  0
 17  9  1  0  0  0  0
 17 14  1  0  0  0  0
 17 15  2  0  0  0  0
 17 16  2  0  0  0  0
M  END
>  <ID>  (1) 
EOS102747

>  <Supplier>  (1) 
SIA Enamine

>  <Supplier_ID>  (1) 
EN300-152496

> <ALATIS_Standard_InChI>
InChI=1S/C12H18N2O2S/c1-10(13-2)11-4-6-12(7-5-11)14-8-3-9-17(14,15)16/h4-7,10,13H,3,8-9H2,1-2H3/t10-/m1/s1

> <ALATIS_Warnings>

> <ALATIS_Errors>

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


> <ALATIS_Mixture_Map>

$$$$
