B9NS8E -OEChem-04022101452D 52 55 0 1 0 0 0 0 0999 V2000 11.2055 3.3924 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.2796 1.9801 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.8673 1.9061 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.2694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.2694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.2694 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.5332 2.0583 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.2306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.7306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0332 3.5971 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5332 2.0583 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.2694 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7933 3.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4624 4.0615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4842 4.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8422 3.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5364 2.6492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 3.3184 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9641 4.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2242 3.0094 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 4.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6551 3.3184 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.2306 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 3.7320 -0.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.2694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9882 3.7330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6947 4.6364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5059 4.8890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8703 4.1831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4061 2.4788 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5706 4.3983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8993 4.8860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0289 4.8860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3576 4.3983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0887 3.5705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3451 2.7814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 1.8132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 1.1229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.3894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 0.3132 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -0.3771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.8894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.4594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -3.0794 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 2 17 1 0 0 0 0 3 17 1 0 0 0 0 4 28 1 0 0 0 0 5 30 1 0 0 0 0 6 32 1 0 0 0 0 7 11 1 0 0 0 0 7 20 1 0 0 0 0 8 23 2 0 0 0 0 9 18 1 0 0 0 0 9 22 1 0 0 0 0 9 23 1 0 0 0 0 10 16 1 0 0 0 0 10 20 2 0 0 0 0 11 16 2 0 0 0 0 25 12 1 6 0 0 0 12 49 1 0 0 0 0 12 50 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 16 1 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 18 37 1 6 0 0 0 19 21 1 0 0 0 0 19 38 1 0 0 0 0 19 39 1 0 0 0 0 21 22 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 22 42 1 0 0 0 0 22 43 1 0 0 0 0 23 24 1 0 0 0 0 24 25 1 0 0 0 0 24 44 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 28 1 0 0 0 0 27 29 2 0 0 0 0 28 31 2 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 30 32 2 0 0 0 0 31 32 1 0 0 0 0 31 52 1 0 0 0 0 M END $$$$