Allaric acid, TMS, ID: R101525 NIST 24032906082D 1 1.00000 0.00000 Copyright by the U.S. Sec. Commerce on behalf of U.S.A. All rights reserved. 38 37 0 0 0 1 V2000 6.5556 3.4981 0.0000 O 0 0 0 0 0 0 0 0 0 5.7553 2.9249 0.0000 C 0 0 0 0 0 0 0 0 0 4.9230 3.5215 0.0000 C 0 0 0 0 0 0 0 0 0 4.0834 2.9640 0.0000 C 0 0 0 0 0 0 0 0 0 3.2833 3.5558 0.0000 C 0 0 0 0 0 0 0 0 0 2.4860 2.9660 0.0000 C 0 0 0 0 0 0 0 0 0 1.6589 3.5239 0.0000 C 0 0 0 0 0 0 0 0 0 0.7650 3.0859 0.0000 O 0 0 0 0 0 0 0 0 0 2.5133 1.9657 0.0000 O 0 0 0 0 0 0 0 0 0 3.2833 4.5514 0.0000 O 0 0 0 0 0 0 0 0 0 4.0598 1.9638 0.0000 O 0 0 0 0 0 0 0 0 0 4.9373 4.5168 0.0000 O 0 0 0 0 0 0 0 0 0 1.7278 4.5214 0.0000 O 0 0 0 0 0 0 0 0 0 5.7551 1.9250 0.0000 O 0 0 0 0 0 0 0 0 0 0.8983 5.0800 0.0000 Si 0 0 0 0 0 0 0 0 0 0.9671 6.0775 0.0000 C 0 0 0 0 0 0 0 0 0 0.0000 4.6407 0.0000 C 0 0 0 0 0 0 0 0 0 0.0247 5.5855 0.0000 C 0 0 0 0 0 0 0 0 0 1.6408 1.4747 0.0000 Si 0 0 0 0 0 0 0 0 0 1.6298 0.4748 0.0000 C 0 0 0 0 0 0 0 0 0 0.7803 1.9841 0.0000 C 0 0 0 0 0 0 0 0 0 0.7721 0.9797 0.0000 C 0 0 0 0 0 0 0 0 0 4.3173 0.9999 0.0000 Si 0 0 0 0 0 0 0 0 0 5.2831 0.7404 0.0000 C 0 0 0 0 0 0 0 0 0 3.6099 0.2933 0.0000 C 0 0 0 0 0 0 0 0 0 4.3173 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 7.4183 3.0049 0.0000 Si 0 0 0 0 0 0 0 0 0 8.2821 3.5084 0.0000 C 0 0 0 0 0 0 0 0 0 7.4224 2.0050 0.0000 C 0 0 0 0 0 0 0 0 0 8.3828 2.7474 0.0000 C 0 0 0 0 0 0 0 0 0 5.7971 5.0249 0.0000 Si 0 0 0 0 0 0 0 0 0 5.7870 6.0249 0.0000 C 0 0 0 0 0 0 0 0 0 6.6681 4.5338 0.0000 C 0 0 0 0 0 0 0 0 0 6.6607 5.5300 0.0000 C 0 0 0 0 0 0 0 0 0 3.0195 5.5249 0.0000 Si 0 0 0 0 0 0 0 0 0 2.0529 5.7809 0.0000 C 0 0 0 0 0 0 0 0 0 3.7245 6.2341 0.0000 C 0 0 0 0 0 0 0 0 0 2.7568 6.4945 0.0000 C 0 0 0 0 0 0 0 0 0 6 7 1 0 0 0 19 20 1 0 0 0 6 9 1 6 0 0 19 21 1 0 0 0 5 10 1 1 0 0 19 22 1 0 0 0 4 11 1 6 0 0 11 23 1 0 0 0 3 12 1 1 0 0 23 24 1 0 0 0 23 25 1 0 0 0 7 13 1 0 0 0 23 26 1 0 0 0 1 2 1 0 0 0 1 27 1 0 0 0 2 14 2 0 0 0 27 28 1 0 0 0 2 3 1 0 0 0 27 29 1 0 0 0 13 15 1 0 0 0 27 30 1 0 0 0 3 4 1 0 0 0 12 31 1 0 0 0 15 16 1 0 0 0 31 32 1 0 0 0 4 5 1 0 0 0 31 33 1 0 0 0 15 17 1 0 0 0 31 34 1 0 0 0 5 6 1 0 0 0 10 35 1 0 0 0 15 18 1 0 0 0 35 36 1 0 0 0 7 8 2 0 0 0 35 37 1 0 0 0 9 19 1 0 0 0 35 38 1 0 0 0 M END