
    alatis_output_mol

 24 24  0  0  0  0  0  0  0  0999 V2000
    4.0790   -6.0919    0.9848 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1309    0.7493   -0.2841 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4882    0.1903   -1.3880 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6253    0.5204    0.9908 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4981   -1.5330    0.2912 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2143   -0.7901    0.0540 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6706   -0.5809   -1.2209 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5304   -0.2433    1.1471 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4228   -3.7534    0.6094 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3914   -1.2500   -2.6407 Cl  0  0  0  0  0  0  0  0  0  0  0  0
    0.9927   -0.4430    2.3903 F   0  0  0  0  0  0  0  0  0  0  0  0
    3.0857   -5.0668    0.7924 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.3214   -2.9652    0.3801 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.5686   -3.3259    0.6380 O   0  0  0  0  0  0  0  0  0  0  0  0
    3.8746   -6.5962    1.9339 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9883   -6.8149    0.1689 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0934   -5.6842    0.9980 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0214    1.3581   -0.4194 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8903    0.3648   -2.3842 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1145    0.9389    1.8657 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9708   -1.1909    1.2189 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2258   -1.3195   -0.5002 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1226   -5.3432    0.6935 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4173   -3.3259    0.6365 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 12  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
  2  3  2  0  0  0  0
  2  4  1  0  0  0  0
  2 18  1  0  0  0  0
  3  7  1  0  0  0  0
  3 19  1  0  0  0  0
  4  8  2  0  0  0  0
  4 20  1  0  0  0  0
  5  6  1  0  0  0  0
  5 21  1  0  0  0  0
  5 22  1  0  0  0  0
  7  6  2  0  0  0  0
  8  6  1  0  0  0  0
  9 13  1  0  0  0  0
 10  7  1  0  0  0  0
 11  8  1  0  0  0  0
 12  9  1  0  0  0  0
 12 23  1  0  0  0  0
 13  5  1  0  0  0  0
 13 24  1  0  0  0  0
 14  9  2  0  0  0  0
M  END
>  <ID>
Z933840894

>  <Barcode>
9990529559

>  <Well>
G01

>  <Plate_ID>
816280-04

>  <MW>
216.64

>  <Well_volume_uL>
200

>  <Concentration_mM>
50

> <ALATIS_Standard_InChI>
InChI=1S/C9H10ClFN2O/c1-12-9(14)13-5-6-7(10)3-2-4-8(6)11/h2-4H,5H2,1H3,(H2,12,13,14)

> <ALATIS_Warnings>

> <ALATIS_Errors>

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


> <ALATIS_Mixture_Map>

$$$$
