
    alatis_output_mol

 28 29  0  0  0  0  0  0  0  0999 V2000
    4.3405    2.5181   -2.4451 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0439    2.4495   -1.9270 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7872    1.5433   -3.3372 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4048   -0.0112    0.2466 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6914    1.1335    0.1907 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6858   -1.3268   -0.0888 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3941   -0.2033   -0.1177 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6419    0.4310   -3.1929 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7771    1.3228   -1.7357 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1815    1.4036   -2.2934 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9339    0.5094   -3.7015 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3618   -0.4297   -4.5555 F   0  0  0  0  0  0  0  0  0  0  0  0
    0.7170    1.1949   -0.2691 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6612   -1.3197    0.4007 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.0006    3.3292   -2.1497 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7055    3.2079   -1.2226 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7908    1.5821   -3.7454 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4502    0.0861    1.3399 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4475   -0.0520   -0.0853 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2686    1.9683   -0.2239 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6876    1.2773    1.2791 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6795   -1.5249   -1.1664 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2050   -2.1612    0.3934 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5470   -0.3443   -1.1935 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3825   -0.2145    0.3526 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0079   -0.3938   -3.5036 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2662    2.2484   -2.0342 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2385    0.5108   -2.2372 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1  3  2  0  0  0  0
  1 15  1  0  0  0  0
  2 10  2  0  0  0  0
  2 16  1  0  0  0  0
  3 11  1  0  0  0  0
  3 17  1  0  0  0  0
  4 13  1  0  0  0  0
  4 18  1  0  0  0  0
  4 19  1  0  0  0  0
  5 13  1  0  0  0  0
  5 20  1  0  0  0  0
  5 21  1  0  0  0  0
  6  4  1  0  0  0  0
  6 22  1  0  0  0  0
  6 23  1  0  0  0  0
  7  5  1  0  0  0  0
  7 24  1  0  0  0  0
  7 25  1  0  0  0  0
  8 10  1  0  0  0  0
  8 26  1  0  0  0  0
  9 13  1  0  0  0  0
  9 27  1  0  0  0  0
  9 28  1  0  0  0  0
 10  9  1  0  0  0  0
 11  8  2  0  0  0  0
 12 11  1  0  0  0  0
 14  6  1  0  0  0  0
 14  7  1  0  0  0  0
M  END
>  <ID>
Z2856434791

>  <Barcode>
9990531831

>  <Well>
A04

>  <Plate_ID>
816280-06

>  <MW>
195.24

>  <Well_volume_uL>
200

>  <Concentration_mM>
50

> <ALATIS_Standard_InChI>
InChI=1S/C11H14FNO/c12-11-3-1-2-10(8-11)9-13-4-6-14-7-5-13/h1-3,8H,4-7,9H2

> <ALATIS_Warnings>

> <ALATIS_Errors>

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


> <ALATIS_Mixture_Map>

$$$$
