HMDB0036717 RDKit 3D trans-beta-Santalol 40 41 0 0 0 0 0 0 0 0999 V2000 -1.0173 1.7879 -1.4101 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5375 0.8196 -0.7125 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6719 -0.0320 -1.1581 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.9248 0.3044 -0.3582 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5655 -0.0760 1.0713 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2386 -0.7256 0.9511 C 0 0 1 0 0 0 0 0 0 0 0 0 -2.3262 -1.3411 -0.4559 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1779 0.3469 0.6334 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.3269 1.4299 1.6835 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1341 -0.3173 0.7943 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3448 0.4869 0.4375 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5483 -0.3494 0.7001 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4027 -0.6644 -0.2542 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2136 -0.1994 -1.6601 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6138 -1.5098 0.0226 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7783 -0.8381 -0.2766 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3938 2.0367 -2.3913 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2054 2.3742 -1.0179 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8154 -0.1114 -2.2147 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2404 1.3386 -0.4656 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7176 -0.3652 -0.7269 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2932 -0.8445 1.4389 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5951 0.7920 1.7545 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9381 -1.4181 1.7102 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4087 -1.8007 -0.7933 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2230 -1.9882 -0.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6564 0.9443 2.6192 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0942 2.1799 1.4195 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3707 1.9894 1.8078 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2148 -1.2879 0.2392 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2419 -0.5853 1.8829 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3647 0.7061 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4542 1.4098 1.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7178 -0.7027 1.7003 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1014 0.9028 -1.7159 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3309 -0.7009 -2.1129 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0852 -0.4517 -2.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6337 -1.7921 1.0901 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5282 -2.4588 -0.5663 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0301 -1.0651 -1.2181 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 8 9 1 1 8 10 1 0 10 11 1 0 11 12 1 0 12 13 2 0 13 14 1 0 13 15 1 0 15 16 1 0 8 2 1 0 7 3 1 0 1 17 1 0 1 18 1 0 3 19 1 6 4 20 1 0 4 21 1 0 5 22 1 0 5 23 1 0 6 24 1 1 7 25 1 0 7 26 1 0 9 27 1 0 9 28 1 0 9 29 1 0 10 30 1 0 10 31 1 0 11 32 1 0 11 33 1 0 12 34 1 0 14 35 1 0 14 36 1 0 14 37 1 0 15 38 1 0 15 39 1 0 16 40 1 0 M END