BA6CV3 -OEChem-04012115542D 61 65 0 1 0 0 0 0 0999 V2000 8.2220 -1.8121 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.8611 -2.5782 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8952 -2.9254 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.6356 1.4257 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9820 -0.8010 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5113 1.6969 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2722 0.2703 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 4.0784 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.3923 -1.6604 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 1.5784 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 2.5784 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8623 -2.5084 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 8.8648 -2.5782 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 10.2370 -3.4356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6229 -3.5485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4709 -4.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3917 -1.6953 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2373 -1.9857 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9216 -0.8472 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5945 -1.2197 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6096 -1.3934 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9364 -0.2800 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4521 0.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9210 -0.8821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3089 0.3124 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2936 0.4860 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9668 -0.6273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 1.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9820 0.8838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4509 -0.0341 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 1.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9814 0.8489 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 2.5784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 1.0437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 3.0784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 3.1131 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.5576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.5992 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5430 -1.9770 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1070 -2.0075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5837 -3.9496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7844 -3.1445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0402 -3.3364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3511 -4.1057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0892 -4.5670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9169 -4.5091 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1012 -1.1130 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3976 -1.9760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5470 -0.1724 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8325 0.0574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2120 -1.4296 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6909 1.4312 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0705 -0.0557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 3.7330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2462 1.5334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7699 -1.3836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0690 2.8884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 1.2455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 2.9113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1310 1.6753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 -0.3098 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 18 1 0 0 0 0 2 17 2 0 0 0 0 3 18 2 0 0 0 0 4 26 1 0 0 0 0 4 55 1 0 0 0 0 5 27 1 0 0 0 0 5 56 1 0 0 0 0 6 32 1 0 0 0 0 6 60 1 0 0 0 0 7 34 1 0 0 0 0 7 61 1 0 0 0 0 8 35 2 0 0 0 0 9 12 1 0 0 0 0 9 17 1 0 0 0 0 9 47 1 0 0 0 0 10 11 1 0 0 0 0 10 28 2 0 0 0 0 11 35 1 0 0 0 0 11 57 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 39 1 0 0 0 0 13 15 1 0 0 0 0 13 40 1 0 0 0 0 14 16 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 19 1 0 0 0 0 18 20 1 0 0 0 0 19 23 2 0 0 0 0 19 24 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 27 1 0 0 0 0 21 48 1 0 0 0 0 22 26 2 0 0 0 0 22 49 1 0 0 0 0 23 29 1 0 0 0 0 23 50 1 0 0 0 0 24 30 2 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 31 1 0 0 0 0 29 32 2 0 0 0 0 29 52 1 0 0 0 0 30 32 1 0 0 0 0 30 53 1 0 0 0 0 31 33 2 0 0 0 0 31 34 1 0 0 0 0 33 35 1 0 0 0 0 33 36 1 0 0 0 0 34 37 2 0 0 0 0 36 38 2 0 0 0 0 36 54 1 0 0 0 0 37 38 1 0 0 0 0 37 58 1 0 0 0 0 38 59 1 0 0 0 0 M END $$$$