BAV1F2 -OEChem-04022103302D 79 82 0 0 0 0 0 0 0999 V2000 3.0000 3.1309 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 4.6309 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 16.1669 0.0669 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5997 0.0557 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.6279 0.2649 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5443 0.3262 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.3331 -2.9845 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.6279 1.9969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6383 -2.6274 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 2.1309 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8335 3.0924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.1309 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1871 3.6304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 4.1309 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.0000 3.1309 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 3.1309 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.4348 -0.9331 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.5688 -1.4331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.4348 0.0669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3009 -1.4331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7028 -0.9331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.3009 0.5669 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.1669 -0.9331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7950 -1.3382 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1279 -0.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6279 0.2649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1279 -0.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1279 1.1309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6279 0.2649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5888 -2.3167 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1279 1.1309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1279 1.1309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 1.1309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5443 1.9356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 1.6309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 0.6309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 2.1309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 0.1309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 1.6309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8660 0.6309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8550 2.8861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1269 -3.9630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1279 2.8629 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8712 -4.6309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1441 4.0429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.8691 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1226 4.2491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1703 -1.9080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9673 -1.9080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2228 0.6495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8242 -0.0407 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9023 -1.9080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6994 -1.9080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6994 1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9023 1.0419 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3789 -1.5157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7775 -0.8254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8179 -1.1381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4379 1.6678 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7105 1.3429 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0202 1.7415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 2.7509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 -0.4891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5516 -3.7318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7992 -4.4894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6648 2.5529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4379 3.3999 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5910 3.1729 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4571 -5.0924 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3326 -5.0450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2852 -4.1694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1236 4.6625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5303 4.1302 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3800 -0.8691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -1.4891 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -0.8691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2505 3.6424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7293 4.3770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9948 4.8558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 14 1 0 0 0 0 1 15 2 0 0 0 0 1 16 2 0 0 0 0 3 22 1 0 0 0 0 3 23 1 0 0 0 0 4 21 1 0 0 0 0 4 26 1 0 0 0 0 5 29 1 0 0 0 0 5 32 1 0 0 0 0 6 33 1 0 0 0 0 6 36 1 0 0 0 0 7 30 1 0 0 0 0 7 42 1 0 0 0 0 8 31 1 0 0 0 0 8 43 1 0 0 0 0 9 30 2 0 0 0 0 10 39 1 0 0 0 0 11 41 1 0 0 0 0 11 45 1 0 0 0 0 12 40 1 0 0 0 0 12 46 1 0 0 0 0 13 41 2 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 20 1 0 0 0 0 18 21 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 22 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 23 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 24 2 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 24 25 1 0 0 0 0 24 30 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 26 28 2 0 0 0 0 27 29 1 0 0 0 0 27 58 1 0 0 0 0 28 31 1 0 0 0 0 28 59 1 0 0 0 0 29 31 2 0 0 0 0 32 33 1 0 0 0 0 32 60 1 0 0 0 0 32 61 1 0 0 0 0 33 34 2 0 0 0 0 34 35 1 0 0 0 0 34 41 1 0 0 0 0 35 36 1 0 0 0 0 35 37 2 0 0 0 0 36 38 2 0 0 0 0 37 39 1 0 0 0 0 37 62 1 0 0 0 0 38 40 1 0 0 0 0 38 63 1 0 0 0 0 39 40 2 0 0 0 0 42 44 1 0 0 0 0 42 64 1 0 0 0 0 42 65 1 0 0 0 0 43 66 1 0 0 0 0 43 67 1 0 0 0 0 43 68 1 0 0 0 0 44 69 1 0 0 0 0 44 70 1 0 0 0 0 44 71 1 0 0 0 0 45 47 1 0 0 0 0 45 72 1 0 0 0 0 45 73 1 0 0 0 0 46 74 1 0 0 0 0 46 75 1 0 0 0 0 46 76 1 0 0 0 0 47 77 1 0 0 0 0 47 78 1 0 0 0 0 47 79 1 0 0 0 0 M CHG 2 2 1 14 -1 M END $$$$