
    alatis_output_mol

 30 31  0  0  0  0  0  0  0  0999 V2000
   -0.5323    4.1222   -1.5234 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4664    3.5151    0.7536 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2225    3.3286   -0.0010 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0630   -3.1062    1.0290 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7018    0.3086    1.1843 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7774   -0.3054   -0.7236 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2088    3.8158   -0.0617 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4827    0.4247    0.4722 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6352    1.4453   -0.0328 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0849   -0.8970    0.3094 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5124    1.0153   -0.6307 N   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0371   -1.3316   -0.2840 N   0  0  0  0  0  0  0  0  0  0  0  0
    3.0660   -0.9550    1.4276 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.8639    2.8108    0.1010 N   0  0  0  0  0  0  0  0  0  0  0  0
    2.0500   -1.6701    0.8990 N   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3665    4.8304   -1.5914 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3242    4.5874   -2.0226 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8034    3.2278   -2.0915 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0889    4.4143    0.8205 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2134    3.2077    1.7734 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0852    2.7365    0.2994 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4486    3.9288    0.8873 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3223    3.9749   -0.8793 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9960    2.5662   -0.1023 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1657   -3.5359    0.5787 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0957   -3.3535    2.0937 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9532   -3.4910    0.5245 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3492    1.0978    1.5410 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7110   -0.5657   -1.2127 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1798    4.7519    0.3649 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  7  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
  2 20  1  0  0  0  0
  2 21  1  0  0  0  0
  3 14  1  0  0  0  0
  3 22  1  0  0  0  0
  3 23  1  0  0  0  0
  3 24  1  0  0  0  0
  4 15  1  0  0  0  0
  4 25  1  0  0  0  0
  4 26  1  0  0  0  0
  4 27  1  0  0  0  0
  5  8  1  0  0  0  0
  5 28  1  0  0  0  0
  6 11  2  0  0  0  0
  6 12  1  0  0  0  0
  6 29  1  0  0  0  0
  7 14  1  0  0  0  0
  7 30  1  0  0  0  0
  9  8  2  0  0  0  0
 10  8  1  0  0  0  0
 11  9  1  0  0  0  0
 12 10  2  0  0  0  0
 13  5  2  0  0  0  0
 13 15  1  0  0  0  0
 14  9  1  0  0  0  0
 15 10  1  0  0  0  0
M  END
>  <ID>
Z328695024

>  <Barcode>
0110705957

>  <Well>
H06

>  <Plate_ID>
816280-03

>  <MW>
205.26

>  <Well_volume_uL>
200

>  <Concentration_mM>
50

> <ALATIS_Standard_InChI>
InChI=1S/C10H15N5/c1-7(2)14(3)9-8-5-13-15(4)10(8)12-6-11-9/h5-7H,1-4H3

> <ALATIS_Warnings>

> <ALATIS_Errors>

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


> <ALATIS_Mixture_Map>

$$$$
