BK5GP7 -OEChem-04012117352D 75 79 0 1 0 0 0 0 0999 V2000 10.1980 2.4007 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 8.4752 2.2226 0.0000 P 0 0 3 0 0 0 0 0 0 0 0 0 13.0400 1.1919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.9405 0.4582 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 15.4211 2.2047 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.8069 3.6633 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6844 2.7204 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4026 0.9626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.1109 1.9924 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6651 1.6362 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.2852 2.8090 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.6063 3.3135 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0615 1.4126 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7897 1.4878 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0283 -2.3767 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.8888 3.0326 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 14.5328 0.2188 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.6783 -0.7997 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -2.4092 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.6045 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.5268 -3.2453 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1045 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.6045 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.0343 1.0857 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 14.4426 1.9985 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 13.7006 2.6689 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.8337 2.1704 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9917 1.7688 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4026 0.9608 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.9422 1.4582 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9889 0.1508 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 15.5328 0.2171 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9209 2.5787 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 16.0313 -0.6498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0313 -0.6464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7523 2.0445 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5298 -1.5150 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5298 -1.5133 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.1045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -1.6045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0283 -2.3784 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1045 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6535 1.1171 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6041 2.5971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1812 3.0075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3512 1.7811 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4309 2.2065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1220 1.5137 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4942 1.1757 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4266 -0.2884 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1158 0.4281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4262 0.8278 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2685 3.0922 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4757 3.0102 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5056 -1.0492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.5069 -0.2521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4113 -0.6453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0999 2.5580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3070 2.4760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4211 -2.1254 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1120 -1.7281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6137 2.7940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.3737 3.9145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 3.1804 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0935 1.5000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -1.6045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2159 -3.7817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 15.1468 -3.2464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.7945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2428 3.8157 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8084 0.8466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -3.9145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.9145 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 11 1 0 0 0 0 1 12 1 0 0 0 0 1 14 2 0 0 0 0 2 10 1 0 0 0 0 2 11 1 0 0 0 0 2 13 1 0 0 0 0 2 16 2 0 0 0 0 3 24 1 0 0 0 0 3 27 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 25 5 1 1 0 0 0 5 64 1 0 0 0 0 26 6 1 1 0 0 0 6 65 1 0 0 0 0 28 7 1 6 0 0 0 7 66 1 0 0 0 0 29 8 1 6 0 0 0 8 67 1 0 0 0 0 9 33 1 0 0 0 0 10 36 1 0 0 0 0 12 72 1 0 0 0 0 13 73 1 0 0 0 0 15 42 2 0 0 0 0 24 17 1 6 0 0 0 17 32 1 0 0 0 0 17 35 1 0 0 0 0 31 18 1 1 0 0 0 18 39 1 0 0 0 0 18 40 1 0 0 0 0 19 40 2 0 0 0 0 19 41 1 0 0 0 0 20 39 2 0 0 0 0 20 44 1 0 0 0 0 21 42 1 0 0 0 0 21 69 1 0 0 0 0 21 70 1 0 0 0 0 22 43 1 0 0 0 0 22 44 2 0 0 0 0 23 43 1 0 0 0 0 23 74 1 0 0 0 0 23 75 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 33 1 6 0 0 0 27 48 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 49 1 0 0 0 0 29 31 1 0 0 0 0 29 50 1 0 0 0 0 30 36 1 1 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 32 34 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 33 55 1 0 0 0 0 33 56 1 0 0 0 0 34 37 1 0 0 0 0 34 57 1 0 0 0 0 34 58 1 0 0 0 0 35 38 2 0 0 0 0 35 59 1 0 0 0 0 36 60 1 0 0 0 0 36 61 1 0 0 0 0 37 38 1 0 0 0 0 37 62 1 0 0 0 0 37 63 1 0 0 0 0 38 42 1 0 0 0 0 39 41 1 0 0 0 0 40 68 1 0 0 0 0 41 43 2 0 0 0 0 44 71 1 0 0 0 0 M END $$$$