
    alatis_output_mol

 35 36  0  0  0  0  0  0  0  0999 V2000
    5.2825   -1.5107    3.7383 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7022   -0.2736    3.0583 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0424   -1.6050   -3.4161 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2418   -2.0555   -3.1311 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6431   -0.6719   -2.5774 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9371   -1.5589   -2.0223 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0314   -1.3386    0.6633 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9097    1.1582    0.9042 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7204   -1.4408    2.1548 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.6911    0.9495    2.4077 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.4667   -0.0478    0.0612 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9457   -0.1934   -1.4676 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3710   -0.5944   -1.1793 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5505    0.7003   -0.6678 F   0  0  0  0  0  0  0  0  0  0  0  0
    1.0013   -0.1070   -0.0237 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2396   -0.3098    2.9352 N   0  0  0  0  0  0  0  0  0  0  0  0
    4.7891   -1.7029    4.6970 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1899   -2.4047    3.1131 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3504   -1.3639    3.9335 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9783    0.5889    3.6776 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1971   -0.1344    2.0902 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5758   -1.9872   -4.2831 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7130   -2.8022   -3.7674 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6510   -0.3191   -2.7683 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9290   -1.9534   -1.8359 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1152   -1.3643    0.5023 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6319   -2.2278    0.1688 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3804    2.0638    0.5842 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9757    1.3438    0.7206 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6332   -1.4934    2.2962 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0908   -2.3943    2.5439 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6143    0.9712    2.6172 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1075    1.8021    2.9589 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8807    0.0995   -0.9455 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5241    0.7340    0.3046 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  1 17  1  0  0  0  0
  1 18  1  0  0  0  0
  1 19  1  0  0  0  0
  2 16  1  0  0  0  0
  2 20  1  0  0  0  0
  2 21  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  2  0  0  0  0
  3 22  1  0  0  0  0
  4  6  2  0  0  0  0
  4 23  1  0  0  0  0
  5 12  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
  7 11  1  0  0  0  0
  7 26  1  0  0  0  0
  7 27  1  0  0  0  0
  8 11  1  0  0  0  0
  8 28  1  0  0  0  0
  8 29  1  0  0  0  0
  9  7  1  0  0  0  0
  9 30  1  0  0  0  0
  9 31  1  0  0  0  0
 10  8  1  0  0  0  0
 10 16  1  0  0  0  0
 10 32  1  0  0  0  0
 10 33  1  0  0  0  0
 11 15  1  0  0  0  0
 11 34  1  0  0  0  0
 12 13  2  0  0  0  0
 13 15  1  0  0  0  0
 14 12  1  0  0  0  0
 15 35  1  0  0  0  0
 16  9  1  0  0  0  0
M  END
>  <ID>
Z2856434868

>  <Barcode>
0110705227

>  <Well>
H12

>  <Plate_ID>
816280-07

>  <MW>
222.31

>  <Well_volume_uL>
200

>  <Concentration_mM>
50

> <ALATIS_Standard_InChI>
InChI=1S/C13H19FN2/c1-2-16-9-7-11(8-10-16)15-13-6-4-3-5-12(13)14/h3-6,11,15H,2,7-10H2,1H3

> <ALATIS_Warnings>

> <ALATIS_Errors>

> <ALATIS_Map>
new index	atom name	original index
1	C	14
2	C	11
3	C	16
4	C	15
5	C	13
6	C	12
7	C	6
8	C	7
9	C	8
10	C	9
11	C	5
12	C	4
13	C	3
14	F	10
15	N	1
16	N	2
17	H	31
18	H	33
19	H	32
20	H	27
21	H	28
22	H	35
23	H	34
24	H	30
25	H	29
26	H	19
27	H	20
28	H	21
29	H	22
30	H	23
31	H	24
32	H	25
33	H	26
34	H	18
35	H	17


> <ALATIS_Mixture_Map>

$$$$
