B1BZ7I -OEChem-04022105512D 46 49 0 1 0 0 0 0 0999 V2000 2.7810 -4.3214 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.0124 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.3924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.3924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.8924 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -2.4736 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.2320 1.5264 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.7320 2.3924 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7320 2.3924 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.2320 0.5264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 2.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 0.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 0.0264 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 2.3924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 3.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -1.4736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 -0.9736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 -0.9736 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4230 -3.0614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0411 -3.0614 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.0124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -4.0124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 2.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 4.3924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 3.8924 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8309 1.3659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5716 2.9913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8925 2.9913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6350 0.3364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8291 0.3364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 1.7724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0611 4.2024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 4.2024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6350 -1.2836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8291 -1.2836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1130 -2.5244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8566 -3.3136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6075 -3.3136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3511 -2.5244 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6672 -4.6290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3385 -4.1413 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8671 2.5824 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 5.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8671 4.2024 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.0124 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 22 1 0 0 0 0 2 22 1 0 0 0 0 3 12 2 0 0 0 0 4 5 1 0 0 0 0 4 46 1 0 0 0 0 5 12 1 0 0 0 0 5 34 1 0 0 0 0 6 17 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 1 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 11 1 6 0 0 0 8 28 1 0 0 0 0 9 12 1 6 0 0 0 9 29 1 0 0 0 0 10 13 2 0 0 0 0 10 14 1 0 0 0 0 11 15 2 0 0 0 0 11 16 1 0 0 0 0 13 18 1 0 0 0 0 13 30 1 0 0 0 0 14 19 2 0 0 0 0 14 31 1 0 0 0 0 15 24 1 0 0 0 0 15 32 1 0 0 0 0 16 25 2 0 0 0 0 16 33 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 18 35 1 0 0 0 0 19 36 1 0 0 0 0 20 22 1 0 0 0 0 20 37 1 0 0 0 0 20 38 1 0 0 0 0 21 23 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 23 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 26 2 0 0 0 0 24 43 1 0 0 0 0 25 26 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 M END $$$$