
    alatis_output_mol

 30 31  0  0  0  0  0  0  0  0999 V2000
    2.5080    1.2389    0.3478 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1798   -0.6345   -0.1785 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2970   -4.7731   -0.6888 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.2293   -4.7533   -0.7066 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0529    0.7369   -0.1517 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2630   -3.5643    0.2442 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1957   -3.5032    0.1767 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1749    0.5728    0.2144 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0279   -5.6261   -0.5831 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0425   -1.3963    0.0255 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0351   -6.4163    0.6521 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.1094    1.3694    0.0426 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.1383   -0.7750    0.2203 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0623   -2.7829   -0.0606 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.7581    1.7524   -0.5862 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4816    1.9741    1.1576 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2950    0.5104    0.5636 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1467   -1.0600   -0.3950 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3928   -4.4163   -1.7233 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1886   -5.3783   -0.4859 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1299   -5.3407   -0.4867 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3203   -4.4324   -1.7532 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9129    1.3794   -0.3159 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1959   -3.0145    0.1014 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2480   -3.8771    1.2960 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2765   -3.7741    1.2379 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0834   -2.9111   -0.0735 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0323   -6.3426   -1.4133 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0594   -5.8135    1.4674 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7769   -7.0331    0.6649 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  8  1  0  0  0  0
  1 15  1  0  0  0  0
  1 16  1  0  0  0  0
  1 17  1  0  0  0  0
  2  5  1  0  0  0  0
  2 10  2  0  0  0  0
  2 18  1  0  0  0  0
  3  6  1  0  0  0  0
  3 19  1  0  0  0  0
  3 20  1  0  0  0  0
  4  7  1  0  0  0  0
  4 21  1  0  0  0  0
  4 22  1  0  0  0  0
  5 12  2  0  0  0  0
  5 23  1  0  0  0  0
  6 14  1  0  0  0  0
  6 24  1  0  0  0  0
  6 25  1  0  0  0  0
  7 14  1  0  0  0  0
  7 26  1  0  0  0  0
  7 27  1  0  0  0  0
  8 13  2  0  0  0  0
  9  3  1  0  0  0  0
  9  4  1  0  0  0  0
  9 28  1  0  0  0  0
 10 13  1  0  0  0  0
 11  9  1  0  0  0  0
 11 29  1  0  0  0  0
 11 30  1  0  0  0  0
 12  8  1  0  0  0  0
 14 10  1  0  0  0  0
M  END
>  <ID>
Z1333043417

>  <Barcode>
9990531690

>  <Well>
E06

>  <Plate_ID>
816280-06

>  <MW>
192.27

>  <Well_volume_uL>
200

>  <Concentration_mM>
50

> <ALATIS_Standard_InChI>
InChI=1S/C10H16N4/c1-8-12-5-2-10(13-8)14-6-3-9(11)4-7-14/h2,5,9H,3-4,6-7,11H2,1H3

> <ALATIS_Warnings>

> <ALATIS_Errors>

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


> <ALATIS_Mixture_Map>

$$$$
