BK7CR9 -OEChem-04012114213D 40 42 0 0 0 0 0 0 0999 V2000 2.6600 -0.8412 0.1242 S 0 0 0 0 0 0 0 0 0 0 0 0 5.3207 -2.1823 0.2715 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7778 -1.1265 -0.0142 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2533 1.1105 0.1576 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5774 0.8352 -0.0978 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7914 1.6983 -0.3405 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6305 -0.3278 -0.1265 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6160 -0.2066 0.2851 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3522 2.1591 0.6539 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3025 -0.2653 -0.5004 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0415 2.1649 -0.1345 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5231 1.1393 0.8824 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9484 0.7052 -0.1278 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4898 0.1146 0.3631 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3646 0.4522 -0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5008 -1.1616 0.9136 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2133 -0.1392 -0.0651 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0839 1.2130 -0.3038 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2630 -0.4997 -1.1452 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3991 -2.1136 0.4315 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2802 -1.7825 -0.5980 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3826 -0.9460 0.0341 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4253 -0.4528 1.3383 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2285 -1.0008 -0.1491 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8240 3.1428 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1393 2.0147 1.7217 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5044 -0.1824 -1.5765 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1225 -1.2596 -0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6194 2.9207 0.3071 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2211 2.4547 -1.1775 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9836 2.1318 0.7857 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3722 0.9889 1.9607 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3589 1.4476 -1.0984 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8320 -1.4312 1.7266 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8980 1.9080 -0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9489 -0.2421 -1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4150 -3.1114 0.8598 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9802 -2.5235 -0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7830 0.6370 -0.3971 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9860 -0.9952 0.9263 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 1 0 0 0 0 1 17 1 0 0 0 0 2 22 2 0 0 0 0 3 7 1 0 0 0 0 3 40 1 0 0 0 0 4 8 1 0 0 0 0 4 9 1 0 0 0 0 4 12 1 0 0 0 0 5 10 1 0 0 0 0 5 11 1 0 0 0 0 5 13 1 0 0 0 0 6 13 2 0 0 0 0 6 18 1 0 0 0 0 7 22 1 0 0 0 0 7 39 1 0 0 0 0 8 10 1 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 9 26 1 0 0 0 0 10 27 1 0 0 0 0 10 28 1 0 0 0 0 11 29 1 0 0 0 0 11 30 1 0 0 0 0 12 14 1 0 0 0 0 12 31 1 0 0 0 0 12 32 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 19 1 0 0 0 0 15 33 1 0 0 0 0 16 20 2 0 0 0 0 16 34 1 0 0 0 0 17 18 2 0 0 0 0 17 22 1 0 0 0 0 18 35 1 0 0 0 0 19 21 2 0 0 0 0 19 36 1 0 0 0 0 20 21 1 0 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 M END $$$$