KEGG:C09068 Candletoxin A ISISHOST03240423212D 1 1.00000 0.00000 8108 48 52 0 1 0 999 V2000 15.8411 -13.7530 0.0000 C 0 0 2 0 0 0 0 0 0 15.8997 -14.5917 0.0000 C 0 0 1 0 0 0 0 0 0 16.5970 -14.1185 0.0000 C 0 0 1 0 0 0 0 0 0 15.0928 -13.3875 0.0000 C 0 0 0 0 0 0 0 0 0 15.8342 -12.9212 0.0000 O 0 0 0 0 0 0 0 0 0 15.2031 -15.0579 0.0000 C 0 0 1 0 0 0 0 0 0 17.3150 -14.5331 0.0000 C 0 0 0 0 0 0 0 0 0 17.3150 -13.6944 0.0000 C 0 0 0 0 0 0 0 0 0 14.3956 -13.8496 0.0000 C 0 0 2 0 0 0 0 0 0 16.5556 -12.4999 0.0000 C 0 0 0 0 0 0 0 0 0 14.4507 -14.6848 0.0000 C 0 0 2 0 0 0 0 0 0 15.3824 -15.8724 0.0000 C 0 0 0 0 0 0 0 0 0 18.0363 -14.1116 0.0000 O 0 0 0 0 0 0 0 0 0 13.6466 -13.4840 0.0000 C 0 0 0 0 0 0 0 0 0 17.2770 -12.9178 0.0000 C 0 0 0 0 0 0 0 0 0 16.5522 -11.6647 0.0000 O 0 0 0 0 0 0 0 0 0 13.7672 -15.0613 0.0000 C 0 0 1 0 0 0 0 0 0 14.4855 -15.4749 0.0000 O 0 0 0 0 0 0 0 0 0 14.8542 -16.5103 0.0000 C 0 0 0 0 0 0 0 0 0 18.7578 -14.5193 0.0000 C 0 0 0 0 0 0 0 0 0 17.9949 -12.4930 0.0000 C 0 0 0 0 0 0 0 0 0 13.5121 -15.8441 0.0000 C 0 0 2 0 0 0 0 0 0 13.1010 -14.5676 0.0000 C 0 0 0 0 0 0 0 0 0 14.0224 -16.5035 0.0000 C 0 0 0 0 0 0 0 0 0 15.5721 -16.9283 0.0000 C 0 0 0 0 0 0 0 0 0 19.4723 -14.0978 0.0000 C 0 0 3 0 0 0 0 0 0 18.7509 -15.3544 0.0000 O 0 0 0 0 0 0 0 0 0 18.7129 -12.9109 0.0000 C 0 0 0 0 0 0 0 0 0 17.9949 -11.6681 0.0000 C 0 0 0 0 0 0 0 0 0 12.6803 -15.8406 0.0000 C 0 0 0 0 0 0 0 0 0 13.2872 -16.6483 0.0000 O 0 0 0 0 0 0 0 0 0 12.4279 -15.0544 0.0000 C 0 0 0 0 0 0 0 0 0 16.2901 -16.5035 0.0000 O 0 0 0 0 0 0 0 0 0 20.1936 -14.5158 0.0000 C 0 0 0 0 0 0 0 0 0 20.1867 -13.6806 0.0000 C 0 0 0 0 0 0 0 0 0 19.4309 -12.4964 0.0000 C 0 0 0 0 0 0 0 0 0 18.7129 -11.2543 0.0000 C 0 0 0 0 0 0 0 0 0 12.1900 -16.5103 0.0000 O 0 0 0 0 0 0 0 0 0 11.6341 -14.7883 0.0000 C 0 0 0 0 0 0 0 0 0 17.0115 -16.9249 0.0000 C 0 0 0 0 0 0 0 0 0 20.9909 -14.2986 0.0000 C 0 0 0 0 0 0 0 0 0 19.4309 -11.6681 0.0000 C 0 0 0 0 0 0 0 0 0 17.7329 -16.5000 0.0000 C 0 0 0 0 0 0 0 0 0 17.0081 -17.7566 0.0000 O 0 0 0 0 0 0 0 0 0 16.6108 -15.0020 0.0000 H 0 0 0 0 0 0 0 0 0 15.9177 -15.4682 0.0000 H 0 0 0 0 0 0 0 0 0 18.7509 -13.6841 0.0000 H 0 0 0 0 0 0 0 0 0 13.8958 -14.2958 0.0000 H 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 1 3 1 0 0 0 1 4 1 0 0 0 1 5 1 6 0 0 2 6 1 0 0 0 3 7 1 6 0 0 3 8 1 1 0 0 4 9 1 0 0 0 5 10 1 0 0 0 6 11 1 0 0 0 6 12 1 0 0 0 7 13 1 0 0 0 9 14 1 6 0 0 10 15 1 0 0 0 10 16 2 0 0 0 11 17 1 0 0 0 11 18 1 6 0 0 12 19 2 0 0 0 13 20 1 0 0 0 15 21 1 0 0 0 17 22 1 0 0 0 17 23 1 0 0 0 19 24 1 0 0 0 19 25 1 0 0 0 20 26 1 0 0 0 20 27 2 0 0 0 21 28 2 0 0 0 21 29 1 0 0 0 22 30 1 0 0 0 22 31 1 1 0 0 23 32 2 0 0 0 25 33 1 0 0 0 26 34 1 0 0 0 26 35 1 0 0 0 28 36 1 0 0 0 29 37 2 0 0 0 30 38 2 0 0 0 32 39 1 0 0 0 33 40 1 0 0 0 34 41 1 0 0 0 36 42 2 0 0 0 40 43 1 0 0 0 40 44 2 0 0 0 2 3 1 0 0 0 9 11 1 0 0 0 22 24 1 0 0 0 30 32 1 0 0 0 37 42 1 0 0 0 2 45 1 6 0 0 6 46 1 1 0 0 26 47 1 4 0 0 17 48 1 6 0 0 M END