B3FXE9 -OEChem-04012118392D 46 50 0 0 0 0 0 0 0999 V2000 3.7817 -3.7122 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7017 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -2.6776 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 0.8224 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9710 1.1543 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8314 2.5554 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -2.6776 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5102 -0.5612 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9641 -1.3989 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3479 -1.1073 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8018 -1.9450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3039 0.4173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 0.3224 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4992 1.8111 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4777 2.0174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -0.6776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7884 2.9679 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 -1.1776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 -1.1776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1205 3.7122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 -2.1776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1420 3.5060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7669 3.1741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 -0.6429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 -2.1776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 -2.7122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -1.1568 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 -2.1984 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0217 -0.2109 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4447 -1.0604 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6255 -1.9183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8673 -1.4459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6865 -0.5879 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4632 -2.4644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3212 -2.2836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3181 0.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9196 0.2148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9331 -0.8676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3131 4.3015 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7280 3.9674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8947 2.5674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3736 3.3020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6390 3.7808 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 -0.0230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 -3.2976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3284 -0.8447 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 28 1 0 0 0 0 3 25 2 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 4 14 1 0 0 0 0 5 12 2 0 0 0 0 5 15 1 0 0 0 0 6 14 2 0 0 0 0 6 22 1 0 0 0 0 7 21 1 0 0 0 0 7 25 1 0 0 0 0 7 45 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 8 29 1 0 0 0 0 9 11 1 0 0 0 0 9 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 13 16 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 15 17 2 0 0 0 0 16 18 1 0 0 0 0 16 19 2 0 0 0 0 17 20 1 0 0 0 0 17 23 1 0 0 0 0 18 21 2 0 0 0 0 18 24 1 0 0 0 0 19 25 1 0 0 0 0 19 38 1 0 0 0 0 20 22 2 0 0 0 0 20 39 1 0 0 0 0 21 26 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 27 2 0 0 0 0 24 44 1 0 0 0 0 26 28 2 0 0 0 0 27 28 1 0 0 0 0 27 46 1 0 0 0 0 M END $$$$