B91NKL -OEChem-04012113552D 63 65 0 0 0 0 0 0 0999 V2000 10.8250 5.8074 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 10.4590 4.4414 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 11.8250 4.0754 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.3402 3.9177 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0571 4.9414 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 12.1910 6.4414 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2566 3.9790 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3402 5.6497 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7123 5.7837 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3402 9.1138 0.0000 N 0 3 0 0 0 0 0 0 0 0 0 0 0.6067 1.2080 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9639 2.9028 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3103 4.2837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8402 4.7837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5672 3.0284 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3103 5.2837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2566 5.5884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8994 2.2841 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4443 3.7837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4443 5.7837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8402 4.7837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5783 5.2837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5783 4.2837 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9209 2.4904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2100 1.3336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8402 6.5158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2530 1.7461 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3402 7.3818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5422 0.5893 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5637 0.7955 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8402 8.2478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3402 7.3818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2745 1.9523 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3402 9.1138 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8402 8.2478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8402 9.9799 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3250 4.9414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1910 5.4414 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9498 2.5405 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1141 3.3205 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4492 6.1777 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4443 3.1637 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4443 6.4037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0414 3.9737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7283 3.0797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9602 5.6497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8167 1.2058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3652 6.9143 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3652 6.1172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7348 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1496 0.3341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1753 5.4737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7123 6.4037 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2202 8.2478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6502 6.8448 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0302 9.6508 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4602 8.2478 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3771 9.6698 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1502 10.5168 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3032 10.2899 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 1.3358 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7993 0.6187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3572 3.0307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 37 1 0 0 0 0 2 37 1 0 0 0 0 3 37 1 0 0 0 0 4 21 2 0 0 0 0 5 38 1 0 0 0 0 6 38 2 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 7 15 1 0 0 0 0 8 21 1 0 0 0 0 8 26 1 0 0 0 0 8 46 1 0 0 0 0 9 22 1 0 0 0 0 9 52 1 0 0 0 0 9 53 1 0 0 0 0 10 34 2 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 33 1 0 0 0 0 11 61 1 0 0 0 0 11 62 1 0 0 0 0 12 33 2 0 0 0 0 12 63 1 0 0 0 0 13 16 2 0 0 0 0 13 19 1 0 0 0 0 14 17 2 0 0 0 0 14 21 1 0 0 0 0 15 18 1 0 0 0 0 15 39 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 41 1 0 0 0 0 18 24 2 0 0 0 0 18 25 1 0 0 0 0 19 23 2 0 0 0 0 19 42 1 0 0 0 0 20 22 2 0 0 0 0 20 43 1 0 0 0 0 22 23 1 0 0 0 0 23 44 1 0 0 0 0 24 27 1 0 0 0 0 24 45 1 0 0 0 0 25 29 2 0 0 0 0 25 47 1 0 0 0 0 26 28 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 30 2 0 0 0 0 27 33 1 0 0 0 0 28 31 2 0 0 0 0 28 32 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 51 1 0 0 0 0 31 34 1 0 0 0 0 31 54 1 0 0 0 0 32 35 2 0 0 0 0 32 55 1 0 0 0 0 34 56 1 0 0 0 0 35 57 1 0 0 0 0 36 58 1 0 0 0 0 36 59 1 0 0 0 0 36 60 1 0 0 0 0 37 38 1 0 0 0 0 M CHG 2 5 -1 10 1 M END $$$$