D0E0GW
-OEChem-04152113083D
44 46 0 0 0 0 0 0 0999 V2000
2.3518 3.8401 -1.1671 Cl 0 0 0 0 0 0 0 0 0 0 0 0
3.3109 -1.3159 0.4500 S 0 0 0 0 0 0 0 0 0 0 0 0
0.2769 -1.5061 -2.4967 S 0 0 0 0 0 0 0 0 0 0 0 0
-4.0072 2.1857 -0.7336 O 0 0 0 0 0 0 0 0 0 0 0 0
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4.7128 -1.0739 0.1644 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9387 -2.1417 1.5827 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0076 -0.0526 0.5943 N 0 0 0 0 0 0 0 0 0 0 0 0
0.3692 -2.1414 0.0073 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5683 -1.8885 -0.9784 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.4229 -1.0633 1.4619 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1396 1.0442 0.1811 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0082 -2.3202 0.7009 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6834 1.7628 -1.0346 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3813 -0.0217 0.3677 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8625 1.0745 -0.5744 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9614 -2.0518 -0.3523 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5496 0.2677 0.6633 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1123 -1.8739 -1.0435 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2092 -1.7183 -1.6673 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7469 1.2993 -0.2547 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7377 0.4727 1.7789 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1324 2.5358 -0.0572 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6195 1.0719 -1.4500 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1232 1.7092 1.9766 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3203 2.7408 1.0583 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1615 -1.3437 2.2221 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5680 -0.6261 1.9918 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1292 0.6797 -0.0165 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0960 1.7342 1.0322 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6156 -3.0586 1.4102 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8850 -2.7756 0.2235 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0801 2.6494 -1.2528 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6862 1.1261 -1.9270 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0486 0.6203 -1.5548 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8184 1.4490 -0.1938 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1590 -1.5930 -2.1676 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0585 -1.8101 -1.8766 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5606 -0.3100 2.5104 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6618 0.9313 -1.1511 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6413 1.9088 -2.1519 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2777 0.2361 -2.0587 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4885 1.8680 2.8435 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8326 3.6977 1.2264 H 0 0 0 0 0 0 0 0 0 0 0 0
1 23 1 0 0 0 0
2 6 2 0 0 0 0
2 7 2 0 0 0 0
2 10 1 0 0 0 0
2 18 1 0 0 0 0
3 19 1 0 0 0 0
3 20 1 0 0 0 0
4 14 1 0 0 0 0
4 16 1 0 0 0 0
5 15 2 0 0 0 0
8 11 1 0 0 0 0
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8 15 1 0 0 0 0
9 17 1 0 0 0 0
9 19 2 0 0 0 0
10 19 1 0 0 0 0
10 38 1 0 0 0 0
11 13 1 0 0 0 0
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11 28 1 0 0 0 0
12 14 1 0 0 0 0
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14 33 1 0 0 0 0
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15 16 1 0 0 0 0
16 35 1 0 0 0 0
16 36 1 0 0 0 0
17 20 2 0 0 0 0
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18 22 1 0 0 0 0
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21 24 1 0 0 0 0
22 25 2 0 0 0 0
22 39 1 0 0 0 0
23 26 2 0 0 0 0
24 40 1 0 0 0 0
24 41 1 0 0 0 0
24 42 1 0 0 0 0
25 26 1 0 0 0 0
25 43 1 0 0 0 0
26 44 1 0 0 0 0
M END
$$$$