B45PMI -OEChem-04042107423D 37 39 0 0 0 0 0 0 0999 V2000 -4.3823 -1.6961 -0.1888 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.4417 -1.6018 0.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8505 3.0433 -0.5478 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7947 2.1213 -0.1953 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7167 0.7851 -0.2553 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6300 -1.4486 -0.6032 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1411 1.0104 0.0897 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2131 0.9927 -1.0322 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8026 1.2837 1.4661 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1364 2.2136 -1.0107 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7278 2.5031 1.4632 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7745 2.4143 0.3589 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5916 -0.3304 0.1335 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9803 -0.3856 -0.0345 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0922 -1.5399 0.3563 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1610 2.0412 -0.3423 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6671 -1.6050 0.0148 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5899 -2.7576 0.4040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9697 -2.7900 0.2331 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1929 -2.3893 -0.3658 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5518 -1.8643 -0.4978 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7221 0.9414 -2.0136 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8574 0.1213 -0.9822 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3985 0.4310 1.8072 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 1.4313 2.2309 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5783 3.1137 -1.2938 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9224 2.0876 -1.7646 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2286 2.5808 2.4353 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1407 3.4210 1.3428 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4557 1.5805 0.5691 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3813 3.3268 0.3523 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3975 3.0527 -0.2671 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7232 0.6970 -0.3654 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0644 -3.6902 0.5915 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4871 -3.7449 0.2775 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7142 -2.4013 -1.3535 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2359 -3.4191 0.0062 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 2 15 1 0 0 0 0 2 20 1 0 0 0 0 3 16 2 0 0 0 0 4 7 1 0 0 0 0 4 16 1 0 0 0 0 4 32 1 0 0 0 0 5 14 1 0 0 0 0 5 16 1 0 0 0 0 5 33 1 0 0 0 0 6 21 3 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 8 10 1 0 0 0 0 8 22 1 0 0 0 0 8 23 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 9 25 1 0 0 0 0 10 12 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 28 1 0 0 0 0 11 29 1 0 0 0 0 12 30 1 0 0 0 0 12 31 1 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 14 17 2 0 0 0 0 15 18 1 0 0 0 0 17 19 1 0 0 0 0 18 19 2 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 M END $$$$