COMPND PENTANE AUTHOR DAVE WOODCOCK 95 12 18 ATOM 1 C 1 2.484 -0.389 0.322 1.00 0.00 ATOM 2 C 1 1.261 0.350 -0.243 1.00 0.00 ATOM 3 C 1 -0.027 -0.348 0.199 1.00 0.00 ATOM 4 C 1 -1.249 0.421 -0.326 1.00 0.00 ATOM 5 C 1 -2.536 -0.311 0.047 1.00 0.00 ATOM 6 H 1 2.471 -1.420 -0.033 1.00 0.00 ATOM 7 H 1 2.443 -0.371 1.412 1.00 0.00 ATOM 8 H 1 3.393 0.112 -0.016 1.00 0.00 ATOM 9 H 1 1.324 0.350 -1.332 1.00 0.00 ATOM 10 H 1 1.271 1.378 0.122 1.00 0.00 ATOM 11 H 1 -0.074 -0.384 1.288 1.00 0.00 ATOM 12 H 1 -0.048 -1.362 -0.205 1.00 0.00 ATOM 13 H 1 -1.183 0.500 -1.412 1.00 0.00 ATOM 14 H 1 -1.259 1.420 0.112 1.00 0.00 ATOM 15 H 1 -2.608 -0.407 1.130 1.00 0.00 ATOM 16 H 1 -2.540 -1.303 -0.404 1.00 0.00 ATOM 17 H 1 -3.393 0.254 -0.321 1.00 0.00 TER 18 1 END