
    alatis_output_mol

 25 25  0  0  0  0  0  0  0  0999 V2000
    2.7762    2.2262    0.3144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1548    0.3001    3.4515 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.6610   -1.1191    2.4980 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1369   -0.8337    3.1413 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6192   -2.1863    2.1818 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0626    0.2868    2.5109 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4915   -2.1448    3.1366 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.6450    0.8024    1.1917 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.7778    1.4631   -1.1921 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.3569   -0.2901   -0.3281 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.6311    0.9445   -0.1458 S   0  0  0  0  0  0  0  0  0  0  0  0
    3.2830    1.9444    1.2383 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5110    2.3140   -0.4901 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2358    3.1674    0.4261 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6784    1.2620    3.3941 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1932    0.1905    4.4873 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0768   -1.3256    3.4947 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5093   -1.2029    1.8163 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6276   -0.6649    2.1756 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9349   -0.8378    3.8920 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2415   -2.0737    1.1590 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0868   -3.1759    2.2349 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8062    0.9861    2.9107 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1437   -2.3619    4.0708 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3406    0.7387    0.9330 H   0  0  0  0  0  0  0  0  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
  1 14  1  0  0  0  0
  2  6  1  0  0  0  0
  2 15  1  0  0  0  0
  2 16  1  0  0  0  0
  3  6  1  0  0  0  0
  3 17  1  0  0  0  0
  3 18  1  0  0  0  0
  4  2  1  0  0  0  0
  4 19  1  0  0  0  0
  4 20  1  0  0  0  0
  5  3  1  0  0  0  0
  5 21  1  0  0  0  0
  5 22  1  0  0  0  0
  6  8  1  0  0  0  0
  6 23  1  0  0  0  0
  7  4  1  0  0  0  0
  7  5  1  0  0  0  0
  7 24  1  0  0  0  0
  8 11  1  0  0  0  0
  8 25  1  0  0  0  0
  9 11  2  0  0  0  0
 10 11  2  0  0  0  0
M  END
>  <ID>
Z212045094

>  <Barcode>
9990531975

>  <Well>
E09

>  <Plate_ID>
816280-05

>  <MW>
178.25

>  <Well_volume_uL>
200

>  <Concentration_mM>
50

> <ALATIS_Standard_InChI>
InChI=1S/C6H14N2O2S/c1-11(9,10)8-6-2-4-7-5-3-6/h6-8H,2-5H2,1H3

> <ALATIS_Warnings>

> <ALATIS_Errors>

> <ALATIS_Map>
new index	atom name	original index
1	C	6
2	C	8
3	C	9
4	C	11
5	C	10
6	C	7
7	N	5
8	N	2
9	O	3
10	O	4
11	S	1
12	H	16
13	H	15
14	H	14
15	H	18
16	H	19
17	H	20
18	H	21
19	H	24
20	H	25
21	H	22
22	H	23
23	H	17
24	H	13
25	H	12


> <ALATIS_Mixture_Map>

$$$$
