B3IK0T -OEChem-04022101242D 44 46 0 0 0 0 0 0 0999 V2000 2.6663 1.5089 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.8435 1.8813 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5756 -0.1187 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8435 -0.1187 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7096 -2.6187 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3134 1.9054 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4416 0.4088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8435 -1.1187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9775 0.3813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7096 -1.6187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9775 1.3813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7096 0.3813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7096 1.3813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0836 -0.1534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0836 1.9160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1775 1.4021 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1775 0.3605 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5756 -3.1187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8435 -3.1187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4455 1.4088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5814 1.9121 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4807 2.9070 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5033 3.1187 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2546 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2330 -1.0110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6315 -1.7013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3201 -1.7264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9216 -1.0361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3201 1.2736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9216 1.9639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0907 -0.7733 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0907 2.5359 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6418 0.0484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2656 -3.6556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1125 -3.4287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8856 -2.5818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5335 -2.5818 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3066 -3.4287 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1535 -3.6556 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9430 3.3201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9035 0.1009 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9773 0.0967 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2533 3.6861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3832 2.1922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 24 1 0 0 0 0 2 11 1 0 0 0 0 2 13 1 0 0 0 0 3 12 2 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 5 10 1 0 0 0 0 5 18 1 0 0 0 0 5 19 1 0 0 0 0 6 16 1 0 0 0 0 6 20 2 0 0 0 0 7 20 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 10 1 0 0 0 0 8 25 1 0 0 0 0 8 26 1 0 0 0 0 9 11 2 0 0 0 0 9 14 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 15 1 0 0 0 0 12 13 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 17 2 0 0 0 0 14 31 1 0 0 0 0 15 16 2 0 0 0 0 15 32 1 0 0 0 0 16 17 1 0 0 0 0 17 33 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 18 36 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 M END $$$$