BS9Q0R -OEChem-04012120102D 59 62 0 0 0 0 0 0 0999 V2000 4.5981 1.0285 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5686 3.5230 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 1.0285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 1.0285 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.0285 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3776 2.1217 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -4.4715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.9715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.4715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.9715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.9715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.9715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -6.4715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.9715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5468 3.7309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 2.8649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.4715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9535 4.6444 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0413 2.7603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.5285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.0285 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9480 4.7490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3657 5.4535 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4480 1.8468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6291 3.5694 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3548 5.6625 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7725 6.3670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4426 1.7423 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6236 3.4648 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7670 6.4715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0303 2.5513 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9441 -5.0541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3426 -4.3639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 -4.3889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 -5.0792 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0781 -6.5541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4766 -5.8639 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.2815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -3.2815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -5.9346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -6.7815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -7.0085 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.6615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.6615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -0.1615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 2.3385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.2815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3125 4.2474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7491 5.3886 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0836 1.3452 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3769 4.1358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9714 5.7273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4080 6.8686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6947 1.1759 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9880 3.9664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0192 7.0379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6469 2.4865 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 5 1 0 0 0 0 1 23 1 0 0 0 0 2 17 1 0 0 0 0 2 22 1 0 0 0 0 5 22 1 0 0 0 0 5 48 1 0 0 0 0 6 18 1 0 0 0 0 6 22 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 10 1 0 0 0 0 8 36 1 0 0 0 0 8 37 1 0 0 0 0 9 11 2 0 0 0 0 9 12 1 0 0 0 0 10 14 1 0 0 0 0 10 38 1 0 0 0 0 10 39 1 0 0 0 0 11 15 1 0 0 0 0 11 40 1 0 0 0 0 12 16 2 0 0 0 0 12 41 1 0 0 0 0 13 15 2 0 0 0 0 13 16 1 0 0 0 0 13 19 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 21 1 0 0 0 0 19 23 2 0 0 0 0 19 47 1 0 0 0 0 20 24 2 0 0 0 0 20 25 1 0 0 0 0 21 26 2 0 0 0 0 21 27 1 0 0 0 0 23 49 1 0 0 0 0 24 28 1 0 0 0 0 24 50 1 0 0 0 0 25 29 2 0 0 0 0 25 51 1 0 0 0 0 26 30 1 0 0 0 0 26 52 1 0 0 0 0 27 31 2 0 0 0 0 27 53 1 0 0 0 0 28 32 2 0 0 0 0 28 54 1 0 0 0 0 29 32 1 0 0 0 0 29 55 1 0 0 0 0 30 33 2 0 0 0 0 30 56 1 0 0 0 0 31 33 1 0 0 0 0 31 57 1 0 0 0 0 32 58 1 0 0 0 0 33 59 1 0 0 0 0 M END $$$$