B4EKB2 -OEChem-04012120082D 73 74 0 1 0 0 0 0 0999 V2000 4.7690 4.3380 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 3.9720 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7690 2.6060 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 0.4720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 0.4720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 2.9720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 2.9720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 3.4720 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 1.4720 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 1.4720 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 1.9720 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 1.4720 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.5280 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -4.0280 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.5280 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 2.9720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 1.9720 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.3312 3.9720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3312 2.9720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3312 2.9720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4651 1.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0632 1.9720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 1.9720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9292 0.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6613 1.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 -0.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 1.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.9720 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 6.8671 1.9720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.9720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 3.4720 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.5280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.0280 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8681 2.2820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9512 3.9720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3312 4.5920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7112 3.9720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3312 2.3520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9512 2.9720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3312 3.5920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3312 3.5920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7112 2.9720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3312 2.3520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 0.8520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1938 2.4469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3967 2.4469 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3187 0.5796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7172 -0.1106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5991 2.5920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.2719 1.3643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.8733 2.0546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3967 -0.5030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1938 -0.5030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3346 0.9970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1316 0.9970 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 1.3520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0569 2.0546 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6584 1.3643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.8520 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 0.2820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.2820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6720 -1.3380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.3380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.3380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9399 -4.3380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.8380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -1.9080 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 35 1 0 0 0 0 2 35 1 0 0 0 0 3 35 1 0 0 0 0 4 25 1 0 0 0 0 4 26 1 0 0 0 0 5 21 2 0 0 0 0 6 22 2 0 0 0 0 7 29 2 0 0 0 0 8 32 2 0 0 0 0 17 9 1 1 0 0 0 9 22 1 0 0 0 0 9 50 1 0 0 0 0 10 22 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 21 1 0 0 0 0 11 27 1 0 0 0 0 11 55 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 12 65 1 0 0 0 0 13 38 1 0 0 0 0 13 39 2 0 0 0 0 14 39 1 0 0 0 0 14 70 1 0 0 0 0 14 71 1 0 0 0 0 15 39 1 0 0 0 0 15 72 1 0 0 0 0 15 73 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 16 20 1 0 0 0 0 17 21 1 0 0 0 0 17 40 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 19 46 1 0 0 0 0 20 47 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 23 25 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 26 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 29 1 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 28 30 1 0 0 0 0 28 32 1 0 0 0 0 28 62 1 0 0 0 0 30 31 1 0 0 0 0 30 63 1 0 0 0 0 30 64 1 0 0 0 0 31 33 2 0 0 0 0 31 34 1 0 0 0 0 32 35 1 0 0 0 0 33 36 1 0 0 0 0 33 66 1 0 0 0 0 34 37 2 0 0 0 0 34 67 1 0 0 0 0 36 38 2 0 0 0 0 36 68 1 0 0 0 0 37 38 1 0 0 0 0 37 69 1 0 0 0 0 M END $$$$