BSC95P -OEChem-04022105082D 67 71 0 0 0 0 0 0 0999 V2000 4.3143 -4.6739 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5053 -5.2617 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1233 -4.0861 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5965 5.1190 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5965 7.1190 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4625 3.6190 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5965 2.1190 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8644 2.1190 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.3644 -0.4198 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7265 -3.8649 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0554 0.5313 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7304 5.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4625 5.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7304 6.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4625 6.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5965 4.1190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5965 8.1190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7304 3.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7304 2.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4625 2.6190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8644 1.1191 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3285 2.1190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3644 -0.4198 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9522 -1.2288 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6734 0.5313 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1333 -2.9514 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5455 -2.1424 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9021 -5.4830 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9467 -1.1243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1278 -2.8468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5345 -1.9333 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4954 -6.3965 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0831 -7.2055 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8966 -5.3784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0777 -7.1010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4844 -6.1874 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6764 -8.1190 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1199 5.7267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5184 5.0364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6746 5.0364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0731 5.7267 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5184 7.2017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1199 6.5114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0731 6.5114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6746 7.2017 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2165 8.1190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5965 8.7390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9765 8.1190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1935 3.9290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3275 2.4290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0185 1.5821 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8655 1.8090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6385 2.6560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2631 0.7229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9289 -2.2072 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.9214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1099 -3.9297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1989 -0.5579 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4922 -3.3484 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1511 -1.8685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8788 -6.4613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1488 -4.8120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4421 -7.6026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1010 -6.1226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1100 -7.8669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4242 -8.6854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2428 -8.3712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 10 1 0 0 0 0 1 28 1 0 0 0 0 4 12 1 0 0 0 0 4 13 1 0 0 0 0 4 16 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 5 17 1 0 0 0 0 6 16 2 0 0 0 0 6 20 1 0 0 0 0 7 19 1 0 0 0 0 7 20 2 0 0 0 0 8 19 1 0 0 0 0 8 21 1 0 0 0 0 8 50 1 0 0 0 0 9 11 1 0 0 0 0 9 23 1 0 0 0 0 9 56 1 0 0 0 0 10 26 1 0 0 0 0 10 57 1 0 0 0 0 11 21 2 0 0 0 0 12 14 1 0 0 0 0 12 38 1 0 0 0 0 12 39 1 0 0 0 0 13 15 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 18 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 19 2 0 0 0 0 18 49 1 0 0 0 0 20 22 1 0 0 0 0 21 25 1 0 0 0 0 22 51 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 1 0 0 0 0 23 25 2 0 0 0 0 24 27 2 0 0 0 0 24 29 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 30 2 0 0 0 0 27 55 1 0 0 0 0 28 32 1 0 0 0 0 28 34 2 0 0 0 0 29 31 2 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 30 59 1 0 0 0 0 31 60 1 0 0 0 0 32 33 2 0 0 0 0 32 61 1 0 0 0 0 33 35 1 0 0 0 0 33 37 1 0 0 0 0 34 36 1 0 0 0 0 34 62 1 0 0 0 0 35 36 2 0 0 0 0 35 63 1 0 0 0 0 36 64 1 0 0 0 0 37 65 1 0 0 0 0 37 66 1 0 0 0 0 37 67 1 0 0 0 0 M END $$$$