42
E = -960.153746160
O         -3.21909       -1.90779       -1.00772
C         -2.28250       -1.27739       -0.57093
O         -1.06625       -1.42250       -1.18267
C         -2.35216       -0.40837        0.67412
C          0.06884       -0.54971       -0.95516
H         -2.00506       -1.08439        1.47645
C         -3.79022        0.00310        0.98145
C         -1.35543        0.76022        0.65717
H          0.03716        0.18043       -1.77903
O          1.22457       -1.30900       -1.15168
C          0.05190        0.21777        0.37358
H         -4.22593        0.59895        0.16815
H         -4.42187       -0.88350        1.10871
H         -3.82516        0.59696        1.90662
H         -1.32132        1.17919        1.67968
C         -1.71161        1.90611       -0.29542
C          1.86681       -1.71235        0.08567
O          0.35386       -0.64654        1.50536
C          1.13129        1.33023        0.37501
H         -1.78649        1.53549       -1.33280
H         -2.70751        2.29486       -0.03889
C         -0.67498        3.02321       -0.20541
O          0.86956       -1.95170        1.05675
C          2.50131       -3.06600       -0.16695
C          2.86154       -0.61875        0.53007
H          1.15163        1.67761        1.42462
C          0.74858        2.54162       -0.50518
C          2.52510        0.78422        0.01362
H         -0.69750        3.45553        0.81156
H         -0.93514        3.84145       -0.89534
H          3.11686       -3.00092       -1.07329
H          1.72073       -3.82092       -0.32292
H          3.13281       -3.35513        0.68262
H          3.85685       -0.89256        0.14905
H          2.91667       -0.64245        1.62785
H          0.77759        2.21022       -1.56076
C          1.74600        3.69278       -0.35279
H          3.28945        1.47887        0.39066
H          2.62669        0.77847       -1.08351
H          1.42610        4.56071       -0.94772
H          2.75577        3.41739       -0.68437
H          1.80947        4.01381        0.69926
