B4OYV7 -OEChem-04012119022D 56 59 0 1 0 0 0 0 0999 V2000 3.8660 -2.8364 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 1.1636 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1910 4.2514 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.8364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 -2.8364 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8660 1.1636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.1636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 1.1636 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -3.8364 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 2.1636 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.4641 2.6636 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -4.3364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -4.3364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -5.2024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -1.8364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.3364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -1.3364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 0.1636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.3364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -0.3364 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 2.6636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 2.6636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 3.6636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 2.1636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8090 4.2514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 5.2024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 5.2024 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 2.1636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 2.6636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 1.1636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 2.1636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 0.6636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 1.1636 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8395 -3.7375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8923 -3.7258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4174 -4.5485 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0250 -5.6010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9750 -5.6010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4030 -4.1464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4631 -1.6464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 -1.6464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4631 -0.0264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2690 -0.0264 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3894 2.7713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7880 2.0810 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1306 3.1385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3335 3.1385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3987 4.0598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 3.2836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8644 5.7040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1356 5.7040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 3.2836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7932 0.8536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5991 2.4736 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 0.0436 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5991 0.8536 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 9 1 0 0 0 0 1 15 1 0 0 0 0 2 6 2 0 0 0 0 2 7 2 0 0 0 0 2 10 1 0 0 0 0 2 18 1 0 0 0 0 3 23 1 0 0 0 0 3 27 1 0 0 0 0 8 24 2 0 0 0 0 9 12 1 0 0 0 0 9 39 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 24 1 0 0 0 0 11 28 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 19 1 0 0 0 0 16 40 1 0 0 0 0 17 20 2 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 42 1 0 0 0 0 20 43 1 0 0 0 0 21 23 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 24 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 25 2 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 29 31 1 0 0 0 0 29 52 1 0 0 0 0 30 32 2 0 0 0 0 30 53 1 0 0 0 0 31 33 2 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 32 55 1 0 0 0 0 33 56 1 0 0 0 0 M END $$$$