BPE4V2 -OEChem-04022100352D 61 63 0 1 0 0 0 0 0999 V2000 4.6473 -0.5396 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8552 0.4385 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -1.0936 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.5663 3.7961 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1825 -2.1869 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5494 0.0784 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8447 -1.8476 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -2.5936 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.3447 -0.3088 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.5936 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.3735 -3.5882 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8517 -2.9300 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3517 -3.7961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3415 -0.8997 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.0142 1.7257 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.3904 -1.2088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3450 2.4688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9277 2.1324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0846 -1.5689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8450 3.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8063 0.7475 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -2.0936 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8232 3.1269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0357 -1.2598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6048 -1.5689 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6537 -1.2598 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3447 -0.3088 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5558 -1.8779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9138 -0.6178 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2958 -2.5199 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3014 -1.9745 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7535 -3.5882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3087 -4.2048 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3532 -3.2945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2665 -2.4693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1601 -4.3857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9181 -4.0482 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9312 -0.7081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4153 1.5652 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8435 2.8333 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9302 2.0081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1193 1.5428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5342 2.2613 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5961 -1.9506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3757 -2.1163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0366 3.9245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2786 3.5870 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1391 0.2700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8447 -2.4676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9803 0.1928 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 -3.2136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2836 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3643 -2.4675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1455 -2.0695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7474 -1.2882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5035 -0.8094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1054 -0.0282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3242 -0.4262 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7061 -2.3283 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1042 -3.1096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8854 -2.7115 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 2 0 0 0 0 2 21 2 0 0 0 0 3 22 2 0 0 0 0 4 23 2 0 0 0 0 5 10 1 0 0 0 0 5 12 1 0 0 0 0 5 16 1 0 0 0 0 14 6 1 1 0 0 0 6 21 1 0 0 0 0 6 48 1 0 0 0 0 7 24 1 0 0 0 0 7 26 1 0 0 0 0 7 49 1 0 0 0 0 8 22 1 0 0 0 0 8 51 1 0 0 0 0 8 52 1 0 0 0 0 9 26 2 0 0 0 0 9 27 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 1 0 0 0 10 31 1 0 0 0 0 11 13 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 14 38 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 15 21 1 6 0 0 0 15 39 1 0 0 0 0 17 20 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 23 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 24 1 0 0 0 0 19 44 1 0 0 0 0 19 45 1 0 0 0 0 20 23 1 0 0 0 0 20 46 1 0 0 0 0 20 47 1 0 0 0 0 24 27 2 0 0 0 0 25 26 1 0 0 0 0 25 28 1 0 0 0 0 25 29 1 0 0 0 0 25 30 1 0 0 0 0 27 50 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 M END $$$$