B2D5BV -OEChem-04012118022D 41 43 0 1 0 0 0 0 0999 V2000 5.9405 0.8067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4026 1.3111 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6844 3.0690 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6651 1.9848 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.3880 2.1629 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.3724 3.5659 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.4512 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -2.0606 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2559 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7559 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.2559 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4026 1.3094 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.9917 2.1174 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9889 0.4994 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9422 1.8067 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.7523 2.3931 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -1.2559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.7559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4752 2.5712 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7559 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1980 2.7492 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1109 2.3409 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1220 1.8623 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4309 2.5550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4266 0.0602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4942 1.5243 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0999 2.9065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3070 2.8246 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0935 1.8486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1000 3.5290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -1.2559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.4459 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -3.5659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -3.5659 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5456 3.2627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7528 3.1807 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8577 1.7750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6768 2.0878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3640 2.9069 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 12 2 1 6 0 0 0 2 31 1 0 0 0 0 13 3 1 6 0 0 0 3 32 1 0 0 0 0 4 16 1 0 0 0 0 4 21 1 0 0 0 0 5 21 1 0 0 0 0 5 23 1 0 0 0 0 6 21 2 0 0 0 0 14 7 1 1 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 8 18 2 0 0 0 0 8 19 1 0 0 0 0 9 17 2 0 0 0 0 9 22 1 0 0 0 0 10 20 1 0 0 0 0 10 22 2 0 0 0 0 11 20 1 0 0 0 0 11 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 13 15 1 0 0 0 0 13 26 1 0 0 0 0 14 27 1 0 0 0 0 15 16 1 1 0 0 0 15 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 19 1 0 0 0 0 18 33 1 0 0 0 0 19 20 2 0 0 0 0 22 34 1 0 0 0 0 23 24 1 0 0 0 0 23 37 1 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 M END $$$$