This file gives the conformational comparisons and the reference ab initio "MP4SDQ/TZP" energy differences for 37 comparisons to experiment. The energy difference is E(Conf 1) - E(Conf 2). Conf 1 Conf 2 MP4SDQ/TZP ---------------------------- AM02A AM02B 1.035 AM04B AM04A 1.900 CA01B CA01A 4.794 CA04A CA04B 0.351 CE01B CE01A 5.648 CE02A CE02B 8.214 CE06B CE06A 0.339 CO03B CO03A 0.835 CO05B CO05A 0.985 CJ01A CJ01B 2.391 CJ02A CJ02B 2.203 CJ07A CJ07B 2.027 HL04A HL04B 0.584 HL05B HL05A 1.286 HL09A HL09B 0.031 HL10A HL10B -0.031 KT02A KT02B 1.299 KT04B KT04A 0.634 NH03A NH03B 0.502 NH04B NH04A 0.690 NH07B NH07A 0.784 NH09B NH09A 3.583 OH02A OH02B -0.056 OH04B OH04A 0.195 OH07D OH07C 0.326 OR01B OR01A 1.406 OR02B OR02A 2.272 OR03B OR03A 1.475 OR04B OR04C -0.006 RA04B RA04A 0.653 RA08B RA08A 6.137 RA10B RA10A 1.688 RA12A RA12B 0.044 RA14A RA14B 1.996 RA16C RA16B 0.985 RE03A RE03B 0.257 RE08B RE08A 1.274