
    alatis_output_mol

 33 34  0  0  0  0  0  0  0  0999 V2000
    3.0906    0.2572   -1.5528 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3889    1.6053   -3.5653 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0784    3.7583    0.0616 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9081    2.2120   -0.3318 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8151    2.5600    0.4581 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9765    1.0434    0.0773 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9476   -0.9749   -2.4363 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3807    0.2980   -4.3473 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7278    1.2736   -1.6605 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2193    1.4214   -2.0462 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5143    3.5048    0.2472 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.4627    1.2808   -0.2023 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.2794   -0.6520   -3.7851 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.1377    0.5840   -1.5920 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8758    0.0078   -0.5099 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6313    2.2874   -3.9666 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3615    2.0874   -3.7288 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1985    4.6218    0.6764 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1142    4.0397   -0.9798 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9278    1.9837   -0.0037 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9436    2.2972   -1.4237 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8674    2.8144    0.3006 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7304    2.4111    1.5443 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0899    0.8701    1.1565 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3081    0.1155   -0.4032 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9377   -1.3979   -2.3965 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6415   -1.7527   -2.1022 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3757   -0.1356   -4.3983 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7050    0.4891   -5.3754 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1573    2.0589   -2.1605 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3574    0.3219   -2.0652 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.5968    2.3418   -1.5913 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0537    4.2539   -0.1859 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 10  1  0  0  0  0
  1 14  1  0  0  0  0
  1 15  1  0  0  0  0
  2 10  1  0  0  0  0
  2 16  1  0  0  0  0
  2 17  1  0  0  0  0
  3  5  1  0  0  0  0
  3 18  1  0  0  0  0
  3 19  1  0  0  0  0
  4  6  1  0  0  0  0
  4 20  1  0  0  0  0
  4 21  1  0  0  0  0
  5 12  1  0  0  0  0
  5 22  1  0  0  0  0
  5 23  1  0  0  0  0
  6 12  1  0  0  0  0
  6 24  1  0  0  0  0
  6 25  1  0  0  0  0
  7  1  1  0  0  0  0
  7 26  1  0  0  0  0
  7 27  1  0  0  0  0
  8  2  1  0  0  0  0
  8 28  1  0  0  0  0
  8 29  1  0  0  0  0
  9 12  1  0  0  0  0
  9 30  1  0  0  0  0
  9 31  1  0  0  0  0
 10  9  1  0  0  0  0
 10 32  1  0  0  0  0
 11  3  1  0  0  0  0
 11  4  1  0  0  0  0
 11 33  1  0  0  0  0
 13  7  1  0  0  0  0
 13  8  1  0  0  0  0
M  END
>  <ID>
Z1267773591

>  <Barcode>
9990531734

>  <Well>
A10

>  <Plate_ID>
816280-06

>  <MW>
184.28

>  <Well_volume_uL>
200

>  <Concentration_mM>
50

> <ALATIS_Standard_InChI>
InChI=1S/C10H20N2O/c1-7-13-8-2-10(1)9-12-5-3-11-4-6-12/h10-11H,1-9H2

> <ALATIS_Warnings>

> <ALATIS_Errors>

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


> <ALATIS_Mixture_Map>

$$$$
