
    alatis_output_mol

 31 32  0  0  0  0  0  0  0  0999 V2000
   -2.0859    4.0395    0.4511 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2111   -1.6686   -0.3246 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6198   -2.9396   -0.7473 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3455    2.7724   -1.4943 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2781    3.7157   -0.0148 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1766    1.3725   -0.8696 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.5104    2.3592    0.6735 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0978   -2.3167   -0.6120 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.1495   -1.3316   -0.2893 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6665   -3.8941   -1.0834 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6852   -3.5878   -1.0015 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6682   -0.0266    0.2106 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0638   -5.1146   -1.4624 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.6045   -4.5216   -1.2827 F   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0681    3.8993   -0.5881 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0675    1.1962   -0.1106 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.6757   -0.0862    0.9182 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0747    4.1860    0.0015 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8858    4.9297    1.0589 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1466    3.1785    1.1241 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9732   -0.9709    0.0056 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6741   -3.1975   -0.7917 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3543    2.8662   -1.9154 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6623    2.8538   -2.3500 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5049    4.5285    0.6859 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0050    3.8210   -0.8310 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0040    1.1915   -0.1747 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2249    0.6279   -1.6692 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5784    2.2665    0.9054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0265    2.3180    1.6276 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1631   -2.1092   -0.5338 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 15  1  0  0  0  0
  1 18  1  0  0  0  0
  1 19  1  0  0  0  0
  1 20  1  0  0  0  0
  2  9  1  0  0  0  0
  2 21  1  0  0  0  0
  3  2  2  0  0  0  0
  3 22  1  0  0  0  0
  4  6  1  0  0  0  0
  4 15  1  0  0  0  0
  4 23  1  0  0  0  0
  4 24  1  0  0  0  0
  5  7  1  0  0  0  0
  5 25  1  0  0  0  0
  5 26  1  0  0  0  0
  6 16  1  0  0  0  0
  6 27  1  0  0  0  0
  6 28  1  0  0  0  0
  7 16  1  0  0  0  0
  7 29  1  0  0  0  0
  7 30  1  0  0  0  0
  8  9  2  0  0  0  0
  8 31  1  0  0  0  0
  9 12  1  0  0  0  0
 10  3  1  0  0  0  0
 10 11  2  0  0  0  0
 11  8  1  0  0  0  0
 13 10  1  0  0  0  0
 14 11  1  0  0  0  0
 15  5  1  0  0  0  0
 16 12  1  0  0  0  0
 17 12  2  0  0  0  0
M  END
>  <ID>
Z2856434829

>  <Barcode>
0110706274

>  <Well>
F11

>  <Plate_ID>
816280-07

>  <MW>
240.25

>  <Well_volume_uL>
200

>  <Concentration_mM>
50

> <ALATIS_Standard_InChI>
InChI=1S/C12H14F2N2O/c1-15-4-6-16(7-5-15)12(17)9-2-3-10(13)11(14)8-9/h2-3,8H,4-7H2,1H3

> <ALATIS_Warnings>

> <ALATIS_Errors>

> <ALATIS_Map>
new index	atom name	original index
1	C	17
2	C	11
3	C	12
4	C	13
5	C	14
6	C	9
7	C	10
8	C	4
9	C	3
10	C	7
11	C	6
12	C	1
13	F	16
14	F	15
15	N	5
16	N	2
17	O	8
18	H	31
19	H	29
20	H	30
21	H	23
22	H	24
23	H	25
24	H	26
25	H	27
26	H	28
27	H	19
28	H	20
29	H	21
30	H	22
31	H	18


> <ALATIS_Mixture_Map>

$$$$
