HMDB0015464 RDKit 3D Yohimbine 52 56 0 0 0 0 0 0 0 0999 V2000 -5.1325 2.6398 -0.3802 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3599 1.4570 -0.1832 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4388 1.3523 0.8555 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3251 2.3532 1.6080 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6323 0.1344 1.0715 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4779 -1.0831 1.3245 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.7085 -0.6230 1.8286 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7825 -1.8739 0.0854 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5741 -2.2039 -0.7359 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3746 -1.5376 -0.1491 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0891 -1.8466 -0.8099 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5199 -0.7752 -1.5240 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5950 -1.1934 -2.3251 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8799 -0.4621 -2.1711 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 0.1609 -0.8641 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9841 0.6211 -0.1758 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4091 1.1477 0.9866 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7462 1.0334 1.0538 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6398 1.4225 2.0421 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9912 1.1955 1.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4442 0.5768 0.7314 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5472 0.1960 -0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1748 0.4137 -0.1065 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6546 0.4456 -0.8287 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.3883 0.6577 0.2082 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6859 -0.0482 -0.0893 C 0 0 2 0 0 0 0 0 0 0 0 0 -6.0984 2.5798 0.1662 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2684 2.8363 -1.4651 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5852 3.5186 0.0259 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0072 0.2905 1.9746 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0553 -1.7445 2.1088 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5619 -0.0297 2.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2284 -2.8409 0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5915 -1.3723 -0.5148 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4449 -3.2838 -0.9121 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7428 -1.7453 -1.7542 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3018 -1.8825 0.9228 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2623 -2.6824 -1.5433 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6757 -2.2539 -0.0973 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3045 -1.1657 -3.4012 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 -2.2826 -2.1087 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 0.3599 -2.9418 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7444 -1.1264 -2.3792 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8236 1.5724 1.7164 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2471 1.9122 2.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6842 1.5003 2.6568 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5166 0.4116 0.6362 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8849 -0.2907 -1.1521 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5715 1.2937 -1.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5964 1.7166 0.3937 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0191 0.2290 1.1838 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1402 0.3193 -1.0152 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 3 5 1 0 5 6 1 0 6 7 1 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 16 24 1 0 24 25 1 0 25 26 1 0 26 5 1 0 26 10 1 0 24 12 1 0 23 15 1 0 23 18 1 0 1 27 1 0 1 28 1 0 1 29 1 0 5 30 1 1 6 31 1 1 7 32 1 0 8 33 1 0 8 34 1 0 9 35 1 0 9 36 1 0 10 37 1 1 11 38 1 0 11 39 1 0 13 40 1 0 13 41 1 0 14 42 1 0 14 43 1 0 17 44 1 0 19 45 1 0 20 46 1 0 21 47 1 0 22 48 1 0 24 49 1 6 25 50 1 0 25 51 1 0 26 52 1 6 M END