
    alatis_output_mol

 18 18  0  0  0  0  0  0  0  0999 V2000
    1.3909   -5.1523   -0.9906 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2665   -0.3180   -1.1129 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2347   -1.5911   -0.0141 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9667    0.5426    0.4894 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7533   -3.7051   -1.1804 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9831   -0.7845   -0.0279 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8454    0.4465   -0.8151 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9024   -2.9973   -0.0112 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.9080   -3.2135   -2.2936 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.2244   -0.2671    1.4219 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.4229   -5.3457   -1.4595 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3283   -5.4236    0.0670 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1595   -5.7739   -1.4603 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5196   -0.5056   -2.1511 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8549   -1.3550   -0.8854 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8320   -1.3928    0.8833 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7694    1.0993    0.9547 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6342   -3.4193    0.8674 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  5  1  0  0  0  0
  1 11  1  0  0  0  0
  1 12  1  0  0  0  0
  1 13  1  0  0  0  0
  2  7  1  0  0  0  0
  2 14  1  0  0  0  0
  3  6  1  0  0  0  0
  3 15  1  0  0  0  0
  3 16  1  0  0  0  0
  4  7  2  0  0  0  0
  4 17  1  0  0  0  0
  5  8  1  0  0  0  0
  6  2  2  0  0  0  0
  8  3  1  0  0  0  0
  8 18  1  0  0  0  0
  9  5  2  0  0  0  0
 10  4  1  0  0  0  0
 10  6  1  0  0  0  0
M  END
>  <ID>
Z1667545918

>  <Barcode>
0110706286

>  <Well>
E02

>  <Plate_ID>
816280-07

>  <MW>
156.21

>  <Well_volume_uL>
200

>  <Concentration_mM>
50

> <ALATIS_Standard_InChI>
InChI=1S/C6H8N2OS/c1-5(9)8-3-6-2-7-4-10-6/h2,4H,3H2,1H3,(H,8,9)

> <ALATIS_Warnings>

> <ALATIS_Errors>

> <ALATIS_Map>
new index	atom name	original index
1	C	10
2	C	5
3	C	9
4	C	4
5	C	6
6	C	2
7	N	1
8	N	7
9	O	8
10	S	3
11	H	18
12	H	16
13	H	17
14	H	12
15	H	14
16	H	15
17	H	11
18	H	13


> <ALATIS_Mixture_Map>

$$$$
