KEGG:C09401 Eleganin ISISHOST03240423222D 1 1.00000 0.00000 8443 36 39 0 1 0 999 V2000 9.6071 -9.5561 0.0000 C 0 0 2 0 0 0 0 0 0 8.7760 -9.5517 0.0000 C 0 0 2 0 0 0 0 0 0 10.3269 -9.9725 0.0000 C 0 0 2 0 0 0 0 0 0 10.3219 -9.1388 0.0000 O 0 0 0 0 0 0 0 0 0 8.0515 -9.9587 0.0000 C 0 0 1 0 0 0 0 0 0 8.0605 -9.1290 0.0000 O 0 0 0 0 0 0 0 0 0 10.5326 -10.7755 0.0000 C 0 0 0 0 0 0 0 0 0 11.0450 -9.5611 0.0000 C 0 0 0 0 0 0 0 0 0 7.8390 -10.7373 0.0000 C 0 0 0 0 0 0 0 0 0 10.3132 -11.5699 0.0000 C 0 0 2 0 0 0 0 0 0 8.0464 -11.5433 0.0000 C 0 0 0 0 0 0 0 0 0 7.0140 -10.7295 0.0000 C 0 0 0 0 0 0 0 0 0 9.5839 -11.9756 0.0000 C 0 0 2 0 0 0 0 0 0 11.0300 -11.9871 0.0000 O 0 0 0 0 0 0 0 0 0 8.7589 -11.9678 0.0000 C 0 0 2 0 0 0 0 0 0 9.8260 -12.7659 0.0000 C 0 0 0 0 0 0 0 0 0 11.7495 -11.5773 0.0000 C 0 0 0 0 0 0 0 0 0 8.4925 -12.7492 0.0000 O 0 0 0 0 0 0 0 0 0 9.1482 -13.2415 0.0000 C 0 0 0 0 0 0 0 0 0 10.6121 -13.0336 0.0000 C 0 0 0 0 0 0 0 0 0 12.4609 -11.9952 0.0000 C 0 0 0 0 0 0 0 0 0 11.7542 -10.7463 0.0000 O 0 0 0 0 0 0 0 0 0 9.1392 -14.0712 0.0000 O 0 0 0 0 0 0 0 0 0 13.1803 -11.5810 0.0000 C 0 0 0 0 0 0 0 0 0 12.4562 -12.8262 0.0000 C 0 0 0 0 0 0 0 0 0 13.1600 -10.7532 0.0000 C 0 0 0 0 0 0 0 0 0 9.6144 -8.7234 0.0000 H 0 0 0 0 0 0 0 0 0 8.9998 -8.7509 0.0000 H 0 0 0 0 0 0 0 0 0 7.3420 -9.5326 0.0000 H 0 0 0 0 0 0 0 0 0 10.3830 -12.1963 0.0000 H 0 0 0 0 0 0 0 0 0 7.9558 -12.1735 0.0000 H 0 0 0 0 0 0 0 0 0 13.8642 -10.3234 0.0000 O 0 0 0 0 0 0 0 0 0 14.5885 -10.7183 0.0000 C 0 0 0 0 0 0 0 0 0 15.2927 -10.2884 0.0000 C 0 0 0 0 0 0 0 0 0 14.6087 -11.5430 0.0000 O 0 0 0 0 0 0 0 0 0 6.5947 -11.4401 0.0000 O 0 0 0 0 0 0 0 0 0 2 6 1 0 0 0 3 7 1 0 0 0 3 8 1 1 0 0 5 9 1 0 0 0 7 10 1 0 0 0 9 11 2 0 0 0 9 12 1 0 0 0 10 13 1 0 0 0 10 14 1 1 0 0 11 15 1 0 0 0 13 16 1 0 0 0 14 17 1 0 0 0 15 18 1 0 0 0 16 19 1 0 0 0 16 20 2 0 0 0 17 21 1 0 0 0 17 22 2 0 0 0 19 23 2 0 0 0 21 24 2 0 0 0 21 25 1 0 0 0 24 26 1 0 0 0 3 4 1 0 0 0 5 6 1 0 0 0 13 15 1 0 0 0 18 19 1 0 0 0 1 27 1 6 0 0 2 28 1 1 0 0 5 29 1 1 0 0 13 30 1 6 0 0 15 31 1 1 0 0 26 32 1 0 0 0 1 2 1 0 0 0 32 33 1 0 0 0 1 3 1 0 0 0 33 34 1 0 0 0 1 4 1 0 0 0 33 35 2 0 0 0 2 5 1 0 0 0 12 36 1 0 0 0 M END