DSHT18 -OEChem-06062108552D 49 52 0 1 0 0 0 0 0999 V2000 3.0000 -4.7694 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.7694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 -3.7694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 12.5054 2.4625 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 0.7306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -2.7694 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9282 2.2306 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 9.0622 0.7306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3871 3.8184 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.6962 4.7694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 -0.7694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.5109 2.5670 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.0109 3.4330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8417 1.8238 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0327 3.2251 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 1.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 2.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 1.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 3.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 0.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 0.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0052 3.8184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4641 0.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6962 4.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -1.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -2.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -0.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -1.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 -2.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -3.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7331 1.9882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5773 3.6852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8193 4.0227 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5317 1.2869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3433 1.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9679 3.8417 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4127 3.2251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8698 2.9640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7932 2.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 -0.3894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5948 3.6268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7975 3.6268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0606 5.2710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0010 -1.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1350 -2.5794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -0.1494 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -3.3894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3291 -0.9594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 31 1 0 0 0 0 2 31 1 0 0 0 0 3 31 1 0 0 0 0 12 4 1 1 0 0 0 4 39 1 0 0 0 0 5 23 2 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 14 1 0 0 0 0 7 15 1 0 0 0 0 7 16 1 0 0 0 0 8 16 1 0 0 0 0 8 21 2 0 0 0 0 9 10 1 0 0 0 0 9 19 1 0 0 0 0 9 43 1 0 0 0 0 10 24 2 0 0 0 0 11 23 1 0 0 0 0 11 25 1 0 0 0 0 11 45 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 32 1 0 0 0 0 13 15 1 0 0 0 0 13 33 1 0 0 0 0 13 34 1 0 0 0 0 14 35 1 0 0 0 0 14 36 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 20 2 0 0 0 0 18 40 1 0 0 0 0 19 22 2 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 41 1 0 0 0 0 22 24 1 0 0 0 0 22 42 1 0 0 0 0 24 44 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 26 28 1 0 0 0 0 26 46 1 0 0 0 0 27 29 2 0 0 0 0 27 47 1 0 0 0 0 28 30 2 0 0 0 0 28 48 1 0 0 0 0 29 30 1 0 0 0 0 29 49 1 0 0 0 0 M END $$$$