HMDB0038207 RDKit 3D gamma-Cadinene 39 40 0 0 0 0 0 0 0 0999 V2000 -0.9912 3.4478 0.0455 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3569 2.3122 -0.1602 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0715 2.2973 -0.5437 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7829 1.2858 0.3284 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 -0.0072 0.4948 C 0 0 2 0 0 0 0 0 0 0 0 0 1.9534 -1.2100 0.4642 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7209 -1.3771 -0.7973 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9122 -1.0629 1.6551 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1047 -0.0941 -0.4554 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.8714 -1.3400 -0.3764 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1812 -1.4429 -0.2208 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8554 -2.7899 -0.1539 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0782 -0.2614 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3412 0.9071 -0.7364 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0487 1.0370 -0.0147 C 0 0 2 0 0 0 0 0 0 0 0 0 -2.0373 3.5118 0.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4959 4.4298 -0.0565 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5345 3.3002 -0.3079 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2008 2.0644 -1.6207 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8014 1.1706 -0.0967 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9504 1.8004 1.3207 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6026 0.0083 1.5308 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3629 -2.1020 0.6645 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8348 -0.4639 -1.3957 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7502 -1.7239 -0.5278 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3123 -2.1608 -1.4782 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3728 -0.5217 2.4626 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2525 -2.0299 2.0243 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7450 -0.3955 1.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 0.0620 -1.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3285 -2.2888 -0.4516 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4656 -2.7852 0.7581 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5569 -2.8073 -1.0243 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1436 -3.6097 -0.2281 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0195 -0.3903 -0.6662 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2506 -0.0098 0.9609 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9346 1.8394 -0.7198 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1111 0.5891 -1.7903 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2516 0.8113 1.0729 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 3 1 0 3 4 1 0 4 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 5 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 11 13 1 0 13 14 1 0 14 15 1 0 15 2 1 0 15 9 1 0 1 16 1 0 1 17 1 0 3 18 1 0 3 19 1 0 4 20 1 0 4 21 1 0 5 22 1 1 6 23 1 0 7 24 1 0 7 25 1 0 7 26 1 0 8 27 1 0 8 28 1 0 8 29 1 0 9 30 1 6 10 31 1 0 12 32 1 0 12 33 1 0 12 34 1 0 13 35 1 0 13 36 1 0 14 37 1 0 14 38 1 0 15 39 1 1 M END