
    alatis_output_mol

 24 25  0  0  0  0  0  0  0  0999 V2000
   -0.5971   -2.3648    0.0580 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2815    2.8464    0.5583 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2759    0.9858   -0.5679 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5073    3.4902    0.4539 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4642    1.6971   -0.6030 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2265    0.0628    0.0209 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1410    1.5738    0.0086 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5021    1.2474   -0.0279 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8757    0.8180    0.0395 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0590    2.5875   -0.1669 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6025    2.9449   -0.1151 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.9437   -0.5268    0.1050 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3199   -0.9481    0.0753 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3961    3.6057   -0.3032 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4182    2.6660   -0.1452 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1545   -2.7900   -0.8466 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1595   -2.8152    0.9516 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6786   -2.5225    0.0518 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4723    3.3540    1.0681 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2407   -0.0178   -0.9799 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6416    4.4957    0.8428 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3607    1.2656   -1.0389 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2829   -0.1590   -0.0133 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8621    1.8111   -0.0420 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 13  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  7  1  0  0  0  0
  2 19  1  0  0  0  0
  3  7  2  0  0  0  0
  3 20  1  0  0  0  0
  4  2  2  0  0  0  0
  4 21  1  0  0  0  0
  5  3  1  0  0  0  0
  5 22  1  0  0  0  0
  6  8  2  0  0  0  0
  6 23  1  0  0  0  0
  7  9  1  0  0  0  0
  9  8  1  0  0  0  0
 10  8  1  0  0  0  0
 11  4  1  0  0  0  0
 11  5  2  0  0  0  0
 12  9  2  0  0  0  0
 12 13  1  0  0  0  0
 13  6  1  0  0  0  0
 14 10  2  0  0  0  0
 15 10  1  0  0  0  0
 15 24  1  0  0  0  0
M  END
>  <ID>
Z815264062

>  <Barcode>
0110705977

>  <Well>
F02

>  <Plate_ID>
816280-03

>  <MW>
203.20

>  <Well_volume_uL>
200

>  <Concentration_mM>
50

> <ALATIS_Standard_InChI>
InChI=1S/C10H9N3O2/c1-13-6-8(10(14)15)9(12-13)7-2-4-11-5-3-7/h2-6H,1H3,(H,14,15)

> <ALATIS_Warnings>

> <ALATIS_Errors>

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


> <ALATIS_Mixture_Map>

$$$$
