FRACTIONS (manually entered): 0.268 0.732 (major structure is shown)
Rel. DFT Energies (kcal/mol): 0.000 0.543

Gaussian numbering

¹H-¹H Js
 -ppm- -#-   H14   H16   H19   H23   H27   H28   H29   H30   H31   H32   H33   H34   H35   H36   H37   H38   H39   H40   H41   
  4.19 H14
  3.94 H16    - 
  3.76 H19    -     - 
  5.76 H23   4.9    -     - 
  6.12 H27   2.1    -     -   -5.9
  5.20 H28    -     -     -     -     - 
  5.00 H29    -     -     -     -     -    0.8
  2.31 H30    -   10.0    -     -     -     -    2.5
  2.86 H31    -    1.4    -     -     -     -    5.6 -14.8
  3.99 H32    -     -    1.3    -     -     -     -     -     - 
  3.39 H33    -     -     -     -     -    8.9    -     -     -    2.6
  2.62 H34    -     -     -     -     -    0.9   1.3    -     -    4.7 -16.0
  3.64 H35    -    9.7    -     -     -     -     -     -     -     -     -     - 
  3.65 H36    -     -     -     -     -     -     -     -     -     -     -     -    9.3
  2.39 H37  10.4    -   11.0    -     -     -     -     -     -     -     -     -     -     - 
  1.42 H38   1.2    -    1.9    -     -     -     -     -     -     -     -     -     -     -  -14.3
  1.62 H39    -     -     -     -     -     -     -     -     -     -     -     -     -    6.0    -     - 
  1.62 H40    -     -     -     -     -     -     -     -     -     -     -     -     -    6.0    -     -     - 
  1.62 H41    -     -     -     -     -     -     -     -     -     -     -     -     -    6.0    -     -     -     - 

¹³C-¹H Js
 -ppm- -#-   H14   H16   H19   H23   H27   H28   H29   H30   H31   H32   H33   H34   H35   H36   H37   H38   H39   H40   H41   
 61.96 C1     -     -     -     -     -  154.6  -5.2   2.0   9.1   8.9  -5.1  -5.9    -     -     -     -     -     -     - 
 65.29 C2     -    3.5    -     -     -    2.4 155.1    -   -4.9    -    5.7   5.5    -     -     -     -     -     -     - 
 44.80 C3     -   -2.8    -     -     -    2.2  -3.0 127.5 134.1    -     -     -    2.1    -     -     -     -     -     - 
 82.06 C4     -  144.2   5.8    -     -     -    7.8  -5.8  -1.5    -     -     -   -3.8   2.3    -     -     -     -     - 
 85.23 C6    3.2   5.7 137.3    -     -     -     -     -     -     -    1.6   7.5    -     -   -5.9  -1.1    -     -     - 
 64.63 C7     -     -    0.9    -     -    3.7    -     -     -  145.8    -   -6.1    -     -    2.6   1.5    -     -     - 
 45.49 C8     -     -    2.1    -     -   -3.4   3.9    -     -   -2.0 129.3 137.1    -     -     -     -     -     -     - 
 63.65 C9     -   -3.1    -     -     -     -     -    2.8   0.9    -     -     -  153.2  -2.6    -     -    4.6   4.6   4.6
 85.20 C10   6.0   2.7    -     -     -     -     -     -     -     -     -     -   -3.5 142.6    -     -   -3.9  -3.9  -3.9
 82.05 C12 141.4    -    3.1  -3.8  -2.4    -     -     -     -     -     -     -     -    6.5  -6.0  -1.6    -     -     - 
 36.66 C13  -2.7    -   -2.6   3.9    -     -     -     -     -    1.3    -    0.6    -     -  137.1 125.2    -     -     - 
 21.09 C21    -     -     -     -     -     -     -     -     -     -     -     -    2.7  -2.4    -     -  129.6 129.6 129.6
105.89 C22  -5.4    -     -  170.9   6.1    -     -     -     -     -     -     -     -     -    2.3   1.7    -     -     - 
204.14 C24   5.0    -     -   -7.2   2.5    -     -     -     -     -     -     -     -     -     -     -     -     -     - 
 81.80 C25  -0.9    -     -    5.9 208.7    -     -     -     -     -     -     -     -     -     -     -     -     -     - 
 -ppm- -#-   H14   H16   H19   H23   H27   H28   H29   H30   H31   H32   H33   H34   H35   H36   H37   H38   H39   H40   H41

¹H data (J_H-H abs sorted)

6.12 (5.9, 2.1)
5.76 (5.9, 4.9)
5.20 (8.9, 0.9, 0.8)
5.00 (5.6, 2.5, 1.3, 0.8)
4.19 (10.4, 4.9, 2.1, 1.2)
3.99 (4.7, 2.6, 1.3)
3.94 (10.0, 9.7, 1.4)
3.76 (11.0, 1.9, 1.3)
3.65 (9.3, 6.0, 6.0, 6.0)
3.64 (9.7, 9.3)
3.39 (16.0, 8.9, 2.6)
2.86 (14.8, 5.6, 1.4)
2.62 (16.0, 4.7, 1.3, 0.9)
2.39 (14.3, 11.0, 10.4)
2.31 (14.8, 10.0, 2.5)
1.62 (6.0)
1.42 (14.3, 1.9, 1.2)

¹³C data

 24 204.1 (-7.2, 5.0, 2.5)
 22 105.9 (170.9, 6.1, -5.4, 2.3)
  6  85.2 (137.3, 7.5, -5.9, 5.7)
 10  85.2 (142.6, 6.0, -3.9, -3.9)
  4  82.1 (144.2, 7.8, -5.8, 5.8)
 12  82.0 (141.4, 6.5, -6.0, -3.8)
 25  81.8 (208.7, 5.9, -0.9)
  2  65.3 (155.1, 5.7, 5.5, -4.9)
  7  64.6 (145.8, -6.1, 3.7, 2.6)
  9  63.7 (153.2, 4.6, 4.6, 4.6)
  1  62.0 (154.6, 9.1, 8.9, -5.9)
  8  45.5 (137.1, 129.3, 3.9, -3.4)
  3  44.8 (134.1, 127.5, -3.0, -2.8)
 13  36.7 (137.1, 125.2, 3.9, -2.7)
 21  21.1 (129.6, 129.6, 129.6, 2.7)

marilzabicycloallene D (0.46Hz/23)