
    alatis_output_mol

 27 28  0  0  0  0  0  0  0  0999 V2000
   -3.6066   -1.4914    0.1060 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6822    3.5793    0.5046 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4057    0.6400    0.0401 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3504   -0.7432   -0.0594 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2211    1.3920    0.1070 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4489    0.7086   -0.2370 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3702   -0.6620    0.4195 C   0  0  3  0  0  0  0  0  0  0  0  0
   -1.3523    2.8593    0.5388 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1132   -1.3668   -0.1004 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0404    0.7775    0.0860 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0762   -0.6314   -0.0233 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0719   -2.7067   -0.1974 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2810    1.5200    0.1430 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3936    3.5121    0.9630 O   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2304   -1.3760   -0.0679 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5466   -2.4679    0.5975 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6897   -1.6835   -0.9698 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5181   -0.9889    0.4442 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5078    3.0471    0.0441 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9601    3.8313    1.5324 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5552    4.5057   -0.0656 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3662    1.1492    0.0635 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2579   -1.3365   -0.1084 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3367    2.4703    0.1458 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4317    0.6286   -1.3319 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3884    1.1728    0.0553 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2803   -0.5646    1.5114 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
  1 18  1  0  0  0  0
  2  8  1  0  0  0  0
  2 19  1  0  0  0  0
  2 20  1  0  0  0  0
  2 21  1  0  0  0  0
  3  5  2  0  0  0  0
  3 22  1  0  0  0  0
  4  3  1  0  0  0  0
  4  9  2  0  0  0  0
  4 23  1  0  0  0  0
  5 10  1  0  0  0  0
  5 24  1  0  0  0  0
  6 13  1  0  0  0  0
  6 25  1  0  0  0  0
  6 26  1  0  0  0  0
  7  6  1  0  0  0  0
  7 27  1  0  0  0  0
  8 13  1  0  0  0  0
  9 11  1  0  0  0  0
 10 13  1  0  0  0  0
 11 10  2  0  0  0  0
 12  9  1  0  0  0  0
 14  8  2  0  0  0  0
 15  7  1  0  0  0  0
 15 11  1  0  0  0  0
M  END
>  <ID>
Z1730522163

>  <Barcode>
0110705768

>  <Well>
H09

>  <Plate_ID>
816280-02

>  <MW>
209.22

>  <Well_volume_uL>
200

>  <Concentration_mM>
50

> <ALATIS_Standard_InChI>
InChI=1S/C11H12FNO2/c1-7-6-13(8(2)14)10-5-3-4-9(12)11(10)15-7/h3-5,7H,6H2,1-2H3/t7-/m1/s1

> <ALATIS_Warnings>

> <ALATIS_Errors>

> <ALATIS_Map>
new index	atom name	original index
1	C	15
2	C	12
3	C	13
4	C	14
5	C	11
6	C	6
7	C	8
8	C	5
9	C	7
10	C	3
11	C	2
12	F	10
13	N	1
14	O	9
15	O	4
16	H	27
17	H	25
18	H	26
19	H	20
20	H	22
21	H	21
22	H	23
23	H	24
24	H	19
25	H	16
26	H	17
27	H	18


> <ALATIS_Mixture_Map>

$$$$
