
    alatis_output_mol

 31 32  0  0  0  0  0  0  0  0999 V2000
    4.1962    0.6325   -1.1449 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4545   -0.6491    0.8886 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5863    0.7109   -1.2751 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8431   -0.5675    0.7587 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.0148   -3.0756   -2.1975 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1831   -3.6167    0.0106 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.4350   -4.3974   -2.3585 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.6003   -4.9376   -0.1536 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2025   -0.1734    0.0376 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9288    0.1277   -0.4951 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.8897   -1.2501   -0.8402 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6272   -0.0587   -0.0703 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4240    0.0993   -0.3319 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.3772   -2.6726   -1.0134 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.2193   -5.3165   -1.3381 C   0  0  0  0  0  0  0  0  0  0  0  0
   11.6086   -6.5873   -1.5018 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.0489   -0.2730    0.1171 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4444   -1.2305   -0.6358 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.5630    1.1016   -1.8958 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0286   -1.1899    1.7309 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.0089    1.2410   -2.1262 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4800   -1.0501    1.4989 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.1847   -2.3650   -3.0034 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.6865   -3.3218    0.9335 H   0  0  0  0  0  0  0  0  0  0  0  0
   11.9235   -4.7189   -3.2726 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4382   -5.6717    0.6287 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1934    0.7264   -1.3756 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.3644    0.6223    0.3815 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1537   -0.6587   -1.7257 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4109   -0.8074    0.0174 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9908   -1.6804   -1.4304 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 12  1  0  0  0  0
  1 19  1  0  0  0  0
  2 12  2  0  0  0  0
  2 20  1  0  0  0  0
  3  1  2  0  0  0  0
  3 13  1  0  0  0  0
  3 21  1  0  0  0  0
  4  2  1  0  0  0  0
  4 22  1  0  0  0  0
  5 14  1  0  0  0  0
  5 23  1  0  0  0  0
  6 14  2  0  0  0  0
  6 24  1  0  0  0  0
  7  5  2  0  0  0  0
  7 15  1  0  0  0  0
  7 25  1  0  0  0  0
  8  6  1  0  0  0  0
  8 26  1  0  0  0  0
  9 17  3  0  0  0  0
 10 13  1  0  0  0  0
 10 27  1  0  0  0  0
 10 28  1  0  0  0  0
 11 18  1  0  0  0  0
 11 29  1  0  0  0  0
 11 30  1  0  0  0  0
 12  9  1  0  0  0  0
 13  4  2  0  0  0  0
 14 11  1  0  0  0  0
 15  8  2  0  0  0  0
 16 15  1  0  0  0  0
 18 10  1  0  0  0  0
 18 31  1  0  0  0  0
M  END
>  <ID>
Z2856434851

>  <Barcode>
0110706278

>  <Well>
E10

>  <Plate_ID>
816280-07

>  <MW>
240.28

>  <Well_volume_uL>
200

>  <Concentration_mM>
50

> <ALATIS_Standard_InChI>
InChI=1S/C15H13FN2/c16-15-7-5-14(6-8-15)11-18-10-13-3-1-12(9-17)2-4-13/h1-8,18H,10-11H2

> <ALATIS_Warnings>

> <ALATIS_Errors>

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


> <ALATIS_Mixture_Map>

$$$$
