HMDB0249319 RDKit 3D Temsavir 58 62 0 0 0 0 0 0 0 0999 V2000 2.6415 4.2095 0.4754 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4519 2.8364 0.3159 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4555 1.8915 0.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7634 2.2906 0.6458 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7225 1.3708 0.7178 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4863 0.0637 0.5567 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5011 -0.9262 0.6313 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4493 -2.0148 1.4322 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5901 -2.7274 1.2333 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3286 -2.0908 0.3290 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6502 -2.5691 -0.1466 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6406 -0.9825 -0.0303 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1962 -0.3758 0.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6859 -1.6077 0.1037 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3648 -1.4855 -0.1026 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9803 -0.1556 -0.0415 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6288 0.3866 -0.2127 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4509 1.6131 -0.1217 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5209 -0.4421 -0.4852 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3637 -1.7020 -0.5846 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8168 0.1028 -0.6453 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.8601 -0.9048 -0.9188 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9159 -0.1638 -1.7406 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3883 0.8646 -0.8899 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.5791 0.9146 -0.1822 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8421 2.0093 0.4862 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.6077 -0.0894 -0.0673 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4906 -1.4171 -0.4119 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5672 -2.3097 -0.3344 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.7684 -1.8262 0.1035 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.9399 -0.5064 0.4631 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8763 0.3421 0.3775 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4548 1.9877 -0.7108 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0418 1.4962 -0.5430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1565 0.5605 0.2193 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6466 4.4505 1.5736 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7346 4.7569 0.0833 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5323 4.6063 -0.0255 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9273 3.3525 0.7722 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6333 -2.2510 2.1013 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2443 -2.9825 0.7186 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2816 -1.7358 -0.5442 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5622 -3.3993 -0.8707 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2395 -2.5008 0.1114 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7268 -2.3362 -0.2871 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3168 -1.1947 0.0293 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4781 -1.7141 -1.5371 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6193 -0.7806 -2.2735 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2599 0.3835 -2.5247 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5457 -1.8269 -0.7155 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4400 -3.3518 -0.6161 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6227 -2.4772 0.1787 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9073 -0.1270 0.8142 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0404 1.3747 0.6647 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7666 2.6214 0.1396 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5435 2.6019 -1.6278 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4057 2.0474 -1.2894 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6933 1.8396 0.4725 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 4 5 1 0 5 6 2 0 6 7 1 0 7 8 1 0 8 9 2 0 9 10 1 0 10 11 1 0 10 12 2 0 6 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 17 19 1 0 19 20 2 0 19 21 1 0 21 22 1 0 22 23 1 0 23 24 1 0 24 25 1 0 25 26 2 0 25 27 1 0 27 28 2 0 28 29 1 0 29 30 2 0 30 31 1 0 31 32 2 0 24 33 1 0 33 34 1 0 16 35 1 0 35 3 1 0 12 7 1 0 35 13 2 0 34 21 1 0 32 27 1 0 1 36 1 0 1 37 1 0 1 38 1 0 4 39 1 0 8 40 1 0 11 41 1 0 11 42 1 0 11 43 1 0 14 44 1 0 15 45 1 0 22 46 1 0 22 47 1 0 23 48 1 0 23 49 1 0 28 50 1 0 29 51 1 0 30 52 1 0 31 53 1 0 32 54 1 0 33 55 1 0 33 56 1 0 34 57 1 0 34 58 1 0 M END