BL6R4S -OEChem-04022118053D 28 30 0 0 0 0 0 0 0999 V2000 6.2665 0.0315 -0.0106 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -6.3786 0.5477 -0.0121 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0649 2.0775 -0.0032 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6569 -2.6540 0.0108 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4727 -1.8094 -0.0016 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6358 1.6743 0.0048 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4517 -0.2808 0.0102 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3472 -0.7156 -0.0012 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8426 0.5773 0.0039 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3883 0.7722 0.0068 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9114 -0.0768 0.0046 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0978 -1.6820 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7261 -0.9038 -0.0053 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5986 0.0127 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6059 0.0262 1.2098 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5606 0.2073 -0.0043 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9722 1.4618 0.0009 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9800 0.2057 -1.2114 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9873 0.2192 1.2047 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6743 0.3090 -0.0059 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8747 -2.7425 -0.0047 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1431 -1.9076 -0.0094 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0711 -0.0663 -2.1535 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0842 -0.0423 2.1614 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5707 2.3679 0.0017 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5023 0.2738 -2.1622 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5152 0.2979 2.1516 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0345 2.1004 -0.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 2 20 1 0 0 0 0 3 10 1 0 0 0 0 3 28 1 0 0 0 0 4 12 2 0 0 0 0 5 8 1 0 0 0 0 5 12 1 0 0 0 0 5 21 1 0 0 0 0 6 9 1 0 0 0 0 6 17 2 0 0 0 0 7 10 2 0 0 0 0 7 11 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 13 1 0 0 0 0 9 10 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 13 16 2 0 0 0 0 13 22 1 0 0 0 0 14 18 1 0 0 0 0 14 23 1 0 0 0 0 15 19 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 17 25 1 0 0 0 0 18 20 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 27 1 0 0 0 0 M END $$$$