KEGG:C02074 Raucaffricine ISISHOST03240423052D 1 1.00000 0.00000 1880 40 46 0 1 0 999 V2000 10.4419 -6.1721 0.0000 C 0 0 2 0 0 0 0 0 0 11.0309 -6.5167 0.0000 O 0 0 0 0 0 0 0 0 0 10.4449 -5.4988 0.0000 C 0 0 1 0 0 0 0 0 0 11.6196 -6.1845 0.0000 C 0 0 1 0 0 0 0 0 0 11.0411 -5.1591 0.0000 C 0 0 2 0 0 0 0 0 0 9.8627 -5.1467 0.0000 O 0 0 0 0 0 0 0 0 0 11.6267 -5.5071 0.0000 C 0 0 2 0 0 0 0 0 0 12.1990 -6.5290 0.0000 C 0 0 0 0 0 0 0 0 0 11.0482 -4.4818 0.0000 O 0 0 0 0 0 0 0 0 0 12.2091 -5.1714 0.0000 O 0 0 0 0 0 0 0 0 0 12.7176 -6.0941 0.0000 O 0 0 0 0 0 0 0 0 0 9.8473 -6.5110 0.0000 O 0 0 0 0 0 0 0 0 0 6.6682 -7.1073 0.0000 C 0 0 1 0 0 0 0 0 0 7.0948 -7.7138 0.0000 C 0 0 0 0 0 0 0 0 0 5.9570 -7.3348 0.0000 C 0 0 0 0 0 0 0 0 0 6.6613 -5.3370 0.0000 C 0 0 1 0 0 0 0 0 0 6.9763 -6.4375 0.0000 C 0 0 0 0 0 0 0 0 0 7.7681 -7.5581 0.0000 C 0 0 1 0 0 0 0 0 0 6.6579 -8.3134 0.0000 N 0 0 0 0 0 0 0 0 0 5.9536 -8.0797 0.0000 C 0 0 0 0 0 0 0 0 0 5.3134 -6.9585 0.0000 C 0 0 0 0 0 0 0 0 0 8.7811 -5.3370 0.0000 C 0 0 3 0 0 0 0 0 0 6.1986 -4.7494 0.0000 O 0 0 0 0 0 0 0 0 0 7.7143 -6.3624 0.0000 C 0 0 1 0 0 0 0 0 0 8.1409 -6.9689 0.0000 N 0 0 3 0 0 0 0 0 0 8.3581 -7.8902 0.0000 C 0 0 0 0 0 0 0 0 0 5.3134 -8.4518 0.0000 C 0 0 0 0 0 0 0 0 0 4.6669 -7.3348 0.0000 C 0 0 0 0 0 0 0 0 0 8.7777 -7.3010 0.0000 C 0 0 1 0 0 0 0 0 0 9.1637 -6.8096 0.0000 C 0 0 1 0 0 0 0 0 0 4.6669 -8.0797 0.0000 C 0 0 0 0 0 0 0 0 0 9.7529 -7.1859 0.0000 C 0 0 0 0 0 0 0 0 0 10.4814 -7.3478 0.0000 C 0 0 0 0 0 0 0 0 0 10.7012 -8.0625 0.0000 C 0 0 0 0 0 0 0 0 0 7.9376 -8.2052 0.0000 H 0 0 0 0 0 0 0 0 0 7.5180 -5.6380 0.0000 H 0 0 0 0 0 0 0 0 0 9.1430 -7.9405 0.0000 H 0 0 0 0 0 0 0 0 0 5.5573 -4.3704 0.0000 C 0 0 0 0 0 0 0 0 0 5.5619 -3.6246 0.0000 O 0 0 0 0 0 0 0 0 0 4.9072 -4.7414 0.0000 C 0 0 0 0 0 0 0 0 0 2 4 1 0 0 0 3 5 1 0 0 0 3 6 1 6 0 0 4 7 1 0 0 0 4 8 1 1 0 0 5 9 1 1 0 0 7 10 1 6 0 0 8 11 1 0 0 0 5 7 1 0 0 0 13 14 1 0 0 0 13 15 1 0 0 0 13 16 1 0 0 0 13 17 1 6 0 0 14 18 1 0 0 0 14 19 2 0 0 0 15 20 2 0 0 0 15 21 1 0 0 0 16 22 1 0 0 0 16 23 1 6 0 0 17 24 1 0 0 0 18 25 1 0 0 0 18 26 1 0 0 0 20 27 1 0 0 0 21 28 2 0 0 0 29 22 1 1 0 0 25 30 1 0 0 0 27 31 2 0 0 0 29 32 1 0 0 0 30 12 1 6 0 0 32 33 2 0 0 0 33 34 1 0 0 0 19 20 1 0 0 0 24 22 1 1 0 0 24 25 1 0 0 0 26 29 1 0 0 0 28 31 1 0 0 0 30 32 1 0 0 0 18 35 1 6 0 0 24 36 1 6 0 0 29 37 1 1 0 0 1 12 1 1 0 0 23 38 1 0 0 0 1 2 1 0 0 0 38 39 2 0 0 0 1 3 1 0 0 0 38 40 1 0 0 0 M END