BW4ME5 -OEChem-04022101212D 86 90 0 0 0 0 0 0 0999 V2000 11.1972 -0.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 5.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 -3.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -1.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 5.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.7500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 2.2500 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -3.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5273 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5273 -4.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 -1.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 2.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5273 -6.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5273 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3933 -5.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 -0.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.3933 -6.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 -0.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 4.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 5.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 1.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 6.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1847 -4.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5832 -5.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8733 -3.8326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2719 -3.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4662 -1.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -4.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 -1.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -3.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 1.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1244 -6.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0643 -2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5273 -4.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 -1.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6025 0.2751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3996 0.2751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 2.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.5273 -7.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.0643 -0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9303 -4.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 -0.4400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.9303 -6.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 0.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0021 4.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5335 1.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7365 1.7250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 5.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0851 6.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 7.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8451 6.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 0.1300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9399 2.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 2 0 0 0 0 2 45 2 0 0 0 0 3 10 1 0 0 0 0 3 11 1 0 0 0 0 3 12 1 0 0 0 0 4 18 1 0 0 0 0 4 31 1 0 0 0 0 4 62 1 0 0 0 0 5 19 1 0 0 0 0 5 32 1 0 0 0 0 5 64 1 0 0 0 0 6 41 1 0 0 0 0 6 45 1 0 0 0 0 6 79 1 0 0 0 0 7 44 1 0 0 0 0 7 46 2 0 0 0 0 8 46 1 0 0 0 0 8 83 1 0 0 0 0 8 84 1 0 0 0 0 9 46 1 0 0 0 0 9 85 1 0 0 0 0 9 86 1 0 0 0 0 10 13 1 0 0 0 0 10 48 1 0 0 0 0 10 49 1 0 0 0 0 11 14 1 0 0 0 0 11 50 1 0 0 0 0 11 51 1 0 0 0 0 12 15 2 0 0 0 0 12 16 1 0 0 0 0 13 25 2 0 0 0 0 13 27 1 0 0 0 0 14 26 2 0 0 0 0 14 28 1 0 0 0 0 15 20 1 0 0 0 0 15 52 1 0 0 0 0 16 21 2 0 0 0 0 16 53 1 0 0 0 0 17 19 2 0 0 0 0 17 23 1 0 0 0 0 17 24 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 19 29 1 0 0 0 0 20 54 1 0 0 0 0 21 55 1 0 0 0 0 22 23 2 0 0 0 0 22 30 1 0 0 0 0 22 31 1 0 0 0 0 23 56 1 0 0 0 0 24 33 2 0 0 0 0 24 34 1 0 0 0 0 25 35 1 0 0 0 0 25 57 1 0 0 0 0 26 36 1 0 0 0 0 26 58 1 0 0 0 0 27 37 2 0 0 0 0 27 59 1 0 0 0 0 28 38 2 0 0 0 0 28 60 1 0 0 0 0 29 30 2 0 0 0 0 29 61 1 0 0 0 0 30 63 1 0 0 0 0 32 44 1 0 0 0 0 32 65 1 0 0 0 0 32 66 1 0 0 0 0 33 42 1 0 0 0 0 33 67 1 0 0 0 0 34 43 2 0 0 0 0 34 68 1 0 0 0 0 35 39 2 0 0 0 0 35 69 1 0 0 0 0 36 40 2 0 0 0 0 36 70 1 0 0 0 0 37 39 1 0 0 0 0 37 71 1 0 0 0 0 38 40 1 0 0 0 0 38 72 1 0 0 0 0 39 73 1 0 0 0 0 40 74 1 0 0 0 0 41 42 2 0 0 0 0 41 43 1 0 0 0 0 42 75 1 0 0 0 0 43 76 1 0 0 0 0 44 77 1 0 0 0 0 44 78 1 0 0 0 0 45 47 1 0 0 0 0 47 80 1 0 0 0 0 47 81 1 0 0 0 0 47 82 1 0 0 0 0 M END $$$$