B0MGZ7 -OEChem-04012119592D 83 86 0 1 0 0 0 0 0999 V2000 4.5506 -4.0333 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 2.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -4.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.9400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -4.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -5.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -5.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3596 -5.4345 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.9400 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.9282 -2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -3.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.9400 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7320 0.5600 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8660 0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -5.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -3.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 5.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8814 -4.7764 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3814 -5.6424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 4.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 6.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 5.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 6.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 6.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -2.3200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3267 -1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5297 -1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4516 -3.8323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8501 -4.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5947 -1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 -1.9650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4048 -3.0477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0063 -2.3574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0063 -4.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4048 -3.8323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 -3.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -2.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -0.8323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -1.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 1.4523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 2.1426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 3.6426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 2.9523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 1.0969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 0.0231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -0.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 2.9774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 3.6677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -6.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 -5.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2520 5.1426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 4.4523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -6.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2648 -4.7116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1292 -6.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.9400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7932 6.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 4.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 7.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 6.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 33 1 0 0 0 0 1 36 1 0 0 0 0 2 23 2 0 0 0 0 3 25 2 0 0 0 0 4 27 2 0 0 0 0 5 28 2 0 0 0 0 6 15 1 0 0 0 0 6 18 1 0 0 0 0 6 24 1 0 0 0 0 7 20 1 0 0 0 0 7 22 1 0 0 0 0 7 27 1 0 0 0 0 19 8 1 1 0 0 0 8 28 1 0 0 0 0 8 57 1 0 0 0 0 9 23 1 0 0 0 0 9 26 1 0 0 0 0 9 29 1 0 0 0 0 10 24 1 0 0 0 0 10 72 1 0 0 0 0 10 73 1 0 0 0 0 11 24 2 0 0 0 0 11 76 1 0 0 0 0 12 33 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 13 43 1 0 0 0 0 14 17 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 19 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 25 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 1 0 0 0 20 23 1 0 0 0 0 20 55 1 0 0 0 0 21 30 1 0 0 0 0 21 31 1 0 0 0 0 21 56 1 0 0 0 0 22 28 1 0 0 0 0 22 58 1 0 0 0 0 22 59 1 0 0 0 0 25 33 1 0 0 0 0 26 27 1 0 0 0 0 26 60 1 0 0 0 0 26 61 1 0 0 0 0 29 32 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 30 64 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 31 67 1 0 0 0 0 31 68 1 0 0 0 0 31 69 1 0 0 0 0 32 34 1 0 0 0 0 32 70 1 0 0 0 0 32 71 1 0 0 0 0 34 35 1 0 0 0 0 34 74 1 0 0 0 0 34 75 1 0 0 0 0 35 38 2 0 0 0 0 35 39 1 0 0 0 0 36 37 2 0 0 0 0 36 77 1 0 0 0 0 37 78 1 0 0 0 0 38 40 1 0 0 0 0 38 79 1 0 0 0 0 39 41 2 0 0 0 0 39 80 1 0 0 0 0 40 42 2 0 0 0 0 40 81 1 0 0 0 0 41 42 1 0 0 0 0 41 82 1 0 0 0 0 42 83 1 0 0 0 0 M END $$$$