BK4UV8 -OEChem-04012120052D 90 95 0 0 0 0 0 0 0999 V2000 7.5981 0.6900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7320 0.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7320 3.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4641 5.1900 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -3.8100 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4641 2.1900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 1.6900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 0.1900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5981 4.6900 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3301 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7320 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5981 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1962 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3301 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4641 3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 0.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1962 3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1962 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0622 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4641 0.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 3.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 1.3239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 3.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 3.0561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5981 3.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0622 3.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1962 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9282 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4641 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 4.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 1.3240 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 4.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 3.0561 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9282 3.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3301 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 5.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.1900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -0.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -1.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8660 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -2.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 -2.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -4.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2680 -3.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1340 -5.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4019 -4.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2680 -5.8100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4019 -5.3100 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7932 1.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8395 1.5911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1306 2.6650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3335 2.6650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0747 3.0823 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6762 3.7726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6592 3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7331 0.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0622 1.0700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9272 0.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 3.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 0.7870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4030 3.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8101 3.5930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3800 0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0622 4.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7331 -1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4651 1.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9272 -1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 5.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 0.7870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4030 5.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1900 3.5930 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4651 3.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3301 -1.9300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 5.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 2.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0611 5.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4030 -1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 -1.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4030 -2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 -2.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4641 5.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2680 -3.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6709 -5.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 -4.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2680 -6.4300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 -5.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 19 2 0 0 0 0 3 28 2 0 0 0 0 4 9 1 0 0 0 0 4 85 1 0 0 0 0 5 46 1 0 0 0 0 5 47 1 0 0 0 0 6 10 1 0 0 0 0 6 13 1 0 0 0 0 6 18 1 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 7 19 1 0 0 0 0 8 19 1 0 0 0 0 8 41 1 0 0 0 0 8 67 1 0 0 0 0 9 28 1 0 0 0 0 9 80 1 0 0 0 0 10 14 1 0 0 0 0 10 15 1 0 0 0 0 10 53 1 0 0 0 0 11 16 1 0 0 0 0 11 17 1 0 0 0 0 11 54 1 0 0 0 0 12 13 1 0 0 0 0 12 55 1 0 0 0 0 12 56 1 0 0 0 0 14 20 2 0 0 0 0 14 22 1 0 0 0 0 15 21 2 0 0 0 0 15 23 1 0 0 0 0 16 24 2 0 0 0 0 16 26 1 0 0 0 0 17 25 2 0 0 0 0 17 27 1 0 0 0 0 18 28 1 0 0 0 0 18 57 1 0 0 0 0 18 58 1 0 0 0 0 20 29 1 0 0 0 0 20 59 1 0 0 0 0 21 30 1 0 0 0 0 21 60 1 0 0 0 0 22 31 2 0 0 0 0 22 61 1 0 0 0 0 23 32 2 0 0 0 0 23 62 1 0 0 0 0 24 33 1 0 0 0 0 24 63 1 0 0 0 0 25 34 1 0 0 0 0 25 64 1 0 0 0 0 26 35 2 0 0 0 0 26 65 1 0 0 0 0 27 36 2 0 0 0 0 27 66 1 0 0 0 0 29 37 2 0 0 0 0 29 68 1 0 0 0 0 30 38 2 0 0 0 0 30 69 1 0 0 0 0 31 37 1 0 0 0 0 31 70 1 0 0 0 0 32 38 1 0 0 0 0 32 71 1 0 0 0 0 33 39 2 0 0 0 0 33 72 1 0 0 0 0 34 40 2 0 0 0 0 34 73 1 0 0 0 0 35 39 1 0 0 0 0 35 74 1 0 0 0 0 36 40 1 0 0 0 0 36 75 1 0 0 0 0 37 76 1 0 0 0 0 38 77 1 0 0 0 0 39 78 1 0 0 0 0 40 79 1 0 0 0 0 41 42 2 0 0 0 0 41 43 1 0 0 0 0 42 44 1 0 0 0 0 42 81 1 0 0 0 0 43 45 2 0 0 0 0 43 82 1 0 0 0 0 44 46 2 0 0 0 0 44 83 1 0 0 0 0 45 46 1 0 0 0 0 45 84 1 0 0 0 0 47 48 2 0 0 0 0 47 49 1 0 0 0 0 48 50 1 0 0 0 0 48 86 1 0 0 0 0 49 51 2 0 0 0 0 49 87 1 0 0 0 0 50 52 2 0 0 0 0 50 88 1 0 0 0 0 51 52 1 0 0 0 0 51 89 1 0 0 0 0 52 90 1 0 0 0 0 M END $$$$