
    alatis_output_mol

 24 24  0  0  0  0  0  0  0  0999 V2000
   -0.9533    1.2576   -1.1118 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2168    0.2992   -1.2393 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3074   -2.0849    2.4044 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5199   -2.0731    3.3183 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8441    0.1893    3.0514 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7322   -0.6768    2.4536 C   0  0  3  0  0  0  0  0  0  0  0  0
    0.9599   -0.0428    0.0426 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7990   -0.6972    3.7251 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1924   -0.2163    1.1730 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.1778   -0.2232    0.0296 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7095    2.1140   -0.4770 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2372    1.6340   -2.1017 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8305    0.7555   -0.6924 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1105   -0.6374   -1.7031 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9519    0.7578   -1.9133 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6010   -2.3858    1.3936 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5660   -2.8149    2.7508 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3869   -2.5131    2.8121 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3333   -2.6759    4.2138 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3592    0.8021    2.3065 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4238    0.8818    3.7898 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1161   -0.6793    3.1504 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7412   -0.4464    3.4182 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8082   -0.0874    1.1112 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  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
  2 15  1  0  0  0  0
  3  6  1  0  0  0  0
  3 16  1  0  0  0  0
  3 17  1  0  0  0  0
  4  3  1  0  0  0  0
  4 18  1  0  0  0  0
  4 19  1  0  0  0  0
  5  6  1  0  0  0  0
  5 20  1  0  0  0  0
  5 21  1  0  0  0  0
  6  9  1  0  0  0  0
  6 22  1  0  0  0  0
  8  4  1  0  0  0  0
  8  5  1  0  0  0  0
  8 23  1  0  0  0  0
  9  7  1  0  0  0  0
  9 24  1  0  0  0  0
 10  7  2  0  0  0  0
M  END
>  <ID>
Z1650040241

>  <Barcode>
9990531713

>  <Well>
C07

>  <Plate_ID>
816280-06

>  <MW>
142.20

>  <Well_volume_uL>
200

>  <Concentration_mM>
50

> <ALATIS_Standard_InChI>
InChI=1S/C7H14N2O/c1-2-7(10)9-6-3-4-8-5-6/h6,8H,2-5H2,1H3,(H,9,10)/t6-/m0/s1

> <ALATIS_Warnings>

> <ALATIS_Errors>

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


> <ALATIS_Mixture_Map>

$$$$
