File: test_json.py.out

package info (click to toggle)
indigo 1.4.3-1
  • links: PTS, VCS
  • area: main
  • in suites: forky, sid
  • size: 48,936 kB
  • sloc: ansic: 332,816; cpp: 169,470; python: 20,033; java: 13,701; cs: 9,979; asm: 8,475; sql: 6,743; xml: 6,354; javascript: 1,245; sh: 555; php: 506; makefile: 54
file content (72 lines) | stat: -rw-r--r-- 3,222 bytes parent folder | download
1
2
3
4
5
6
7
8
9
10
11
12
13
14
15
16
17
18
19
20
21
22
23
24
25
26
27
28
29
30
31
32
33
34
35
36
37
38
39
40
41
42
43
44
45
46
47
48
49
50
51
52
53
54
55
56
57
58
59
60
61
62
63
64
65
66
67
68
69
70
71
72

  -INDIGO-01000000003D

  3  2  0  0  0  0  0  0  0  0999 V2000
   -0.7622    1.1686    0.0228 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6310    1.2429   -0.0130 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6310    1.2429   -0.0130 N   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  2  0  0  0  0
M  END

{"root":{"id":"","type":"molecule","atoms":[{"id":"a1","label":"N"},{"id":"a2","label":"C"},{"id":"a3","label":"N"},{"id":"a4","label":"C"},{"id":"a5","label":"N"},{"id":"a6","label":"C"},{"id":"a7","label":"N"},{"id":"a8","label":"C"},{"id":"a9","label":"N"},{"id":"a10","label":"C"}],"bonds":[{"atoms":["a1","a2"],"order":1},{"atoms":["a2","a3"],"order":4},{"atoms":["a3","a4"],"order":4},{"atoms":["a4","a5"],"order":4},{"atoms":["a5","a6"],"order":4},{"atoms":["a6","a7"],"order":4},{"atoms":["a7","a8"],"order":4},{"atoms":["a8","a9"],"order":4},{"atoms":["a9","a10"],"order":4},{"atoms":["a10","a2"],"order":4},{"atoms":["a6","a10"],"order":1}]}}

  -INDIGO-01000000002D

 10 11  0  0  0  0  0  0  0  0999 V2000
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  4  0  0  0  0
  3  4  4  0  0  0  0
  4  5  4  0  0  0  0
  5  6  4  0  0  0  0
  6  7  4  0  0  0  0
  7  8  4  0  0  0  0
  8  9  4  0  0  0  0
  9 10  4  0  0  0  0
 10  2  4  0  0  0  0
  6 10  1  0  0  0  0
M  STY  1   1 DAT
M  SLB  1   1   1
M  SAL   1  1   3
M  SDT   1 MRV_IMPLICIT_H                                                       
M  SDD   1     0.0000    0.0000    DA    ALL  1       1  
M  SED   1 IMPL_H1
M  END


  -INDIGO-01000000002D

 10 11  0  0  0  0  0  0  0  0999 V2000
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  4  0  0  0  0
  3  4  4  0  0  0  0
  4  5  4  0  0  0  0
  5  6  4  0  0  0  0
  6  7  4  0  0  0  0
  7  8  4  0  0  0  0
  8  9  4  0  0  0  0
  9 10  4  0  0  0  0
 10  2  4  0  0  0  0
  6 10  1  0  0  0  0
M  END