COMPND CYCLOHEXANONE AUTHOR DAVE WOODCOCK 96 06 28 ATOM 1 C 1 1.007 0.692 0.795 1.00 0.00 ATOM 2 O 1 1.604 1.748 1.431 1.00 0.00 ATOM 3 C 1 -0.051 -0.150 1.521 1.00 0.00 ATOM 4 C 1 -1.262 -0.325 0.583 1.00 0.00 ATOM 5 C 1 -0.834 -0.865 -0.788 1.00 0.00 ATOM 6 C 1 0.113 0.130 -1.464 1.00 0.00 ATOM 7 C 1 1.400 0.330 -0.644 1.00 0.00 ATOM 8 H 1 -0.362 0.345 2.443 1.00 0.00 ATOM 9 H 1 0.375 -1.128 1.753 1.00 0.00 ATOM 10 H 1 -1.770 0.632 0.452 1.00 0.00 ATOM 11 H 1 -1.947 -1.045 1.031 1.00 0.00 ATOM 12 H 1 -1.709 -1.040 -1.417 1.00 0.00 ATOM 13 H 1 -0.300 -1.803 -0.637 1.00 0.00 ATOM 14 H 1 -0.394 1.088 -1.593 1.00 0.00 ATOM 15 H 1 0.391 -0.277 -2.436 1.00 0.00 ATOM 16 H 1 1.998 1.128 -1.088 1.00 0.00 ATOM 17 H 1 1.970 -0.600 -0.634 1.00 0.00 TER 18 1 END