BB42OT -OEChem-04012114333D 32 32 0 1 0 0 0 0 0999 V2000 0.8938 -0.0839 0.6852 P 0 0 2 0 0 0 0 0 0 0 0 0 0.1242 1.3121 0.3731 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0389 -0.3219 2.1653 O 0 0 0 0 0 0 0 0 0 0 0 0 5.6811 1.2025 -0.2267 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 -0.4918 -1.3481 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2769 -0.0451 -0.2272 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5758 -2.5096 0.0530 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2103 -1.2857 -0.0864 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.5631 -1.4816 0.6037 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6129 -0.4983 0.1495 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3544 0.8482 0.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7504 0.7081 0.8189 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4224 -0.8172 -0.9301 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 1.6175 0.3989 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3930 0.0924 -1.3502 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5422 1.3097 -0.6856 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6059 0.4447 -0.5613 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3354 -1.0559 -1.1504 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9501 -2.4911 0.4054 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4528 -1.4228 1.6942 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1443 0.0217 -1.2363 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4455 -2.4183 -0.4714 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0747 -3.2898 -0.3703 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5432 0.7598 1.2422 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1027 1.8823 -0.0833 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1308 0.9511 1.6772 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3125 -1.7612 -1.4561 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5431 2.1542 0.6515 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8402 2.5634 0.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0322 -0.1469 -2.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2985 2.0174 -1.0121 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4924 0.9145 -0.6971 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 2 0 0 0 0 1 6 1 0 0 0 0 1 8 1 0 0 0 0 2 28 1 0 0 0 0 4 17 1 0 0 0 0 4 32 1 0 0 0 0 5 17 2 0 0 0 0 6 11 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 22 1 0 0 0 0 7 23 1 0 0 0 0 8 9 1 0 0 0 0 8 18 1 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 10 12 2 0 0 0 0 10 13 1 0 0 0 0 11 17 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 14 1 0 0 0 0 12 26 1 0 0 0 0 13 15 2 0 0 0 0 13 27 1 0 0 0 0 14 16 2 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 M END $$$$