@MOLECULE 2-(1h-indol-2-ylcarbonyl)-1h-indol-5-yl butyrate 44 47 0 0 0 SMALL GASTEIGER @ATOM 1 O -4.6454 0.3670 0.6918 O.3 1 UNL1111111111 -0.4298 2 O 2.6620 3.0734 -0.8456 O.2 1 UNL1111111111 -0.3723 3 O -4.6189 -1.3053 -0.8218 O.2 1 UNL1111111111 -0.4709 4 N 0.8148 0.6591 0.9928 N.ar 1 UNL1111111111 -0.3655 5 N 3.2448 -0.4265 -0.4115 N.ar 1 UNL1111111111 -0.3684 6 C -1.1755 1.2159 0.0144 C.ar 1 UNL1111111111 -0.0606 7 C 1.0678 1.5408 -0.0707 C.ar 1 UNL1111111111 -0.0484 8 C -0.5612 0.4736 1.0773 C.ar 1 UNL1111111111 0.1004 9 C 3.4980 0.9542 -0.3257 C.ar 1 UNL1111111111 -0.0673 10 C -0.1240 1.8893 -0.6863 C.ar 1 UNL1111111111 -0.1586 11 C 2.4317 1.9578 -0.4435 C.2 1 UNL1111111111 0.4484 12 C 4.4583 -1.0919 -0.3054 C.ar 1 UNL1111111111 0.1326 13 C 5.4880 -0.1141 -0.1112 C.ar 1 UNL1111111111 -0.1004 14 C 4.8551 1.1692 -0.1357 C.ar 1 UNL1111111111 -0.1446 15 C -2.5651 1.1544 -0.1541 C.ar 1 UNL1111111111 -0.1558 16 C -1.3042 -0.3065 1.9806 C.ar 1 UNL1111111111 -0.1860 17 C -3.2639 0.3754 0.7453 C.ar 1 UNL1111111111 0.1902 18 C -2.6698 -0.3523 1.8029 C.ar 1 UNL1111111111 -0.1527 19 C 4.7395 -2.4681 -0.3439 C.ar 1 UNL1111111111 -0.2234 20 C 6.8148 -0.5395 0.0485 C.ar 1 UNL1111111111 -0.0876 21 C 6.0565 -2.8444 -0.1849 C.ar 1 UNL1111111111 -0.0951 22 C 7.0855 -1.8916 0.0103 C.ar 1 UNL1111111111 -0.2038 23 C -6.7271 -0.3546 -0.0432 C.3 1 UNL1111111111 -0.3494 24 C -7.4417 -1.2839 -1.0291 C.3 1 UNL1111111111 -0.2333 25 C -5.2459 -0.5362 -0.1505 C.2 1 UNL1111111111 0.6078 26 C -8.9543 -1.0988 -0.9459 C.3 1 UNL1111111111 -0.4400 27 H -0.2456 2.5383 -1.5307 H 1 UNL1111111111 0.1802 28 H 1.4867 0.3712 1.6701 H 1 UNL1111111111 0.3219 29 H 2.3621 -0.8300 -0.6363 H 1 UNL1111111111 0.3252 30 H 5.3466 2.1161 -0.0303 H 1 UNL1111111111 0.1784 31 H -3.0620 1.6930 -0.9559 H 1 UNL1111111111 0.1755 32 H -0.8145 -0.8520 2.7812 H 1 UNL1111111111 0.1640 33 H -3.3092 -0.9386 2.4608 H 1 UNL1111111111 0.1698 34 H 3.9502 -3.1960 -0.4945 H 1 UNL1111111111 0.1615 35 H 7.6037 0.1947 0.1975 H 1 UNL1111111111 0.1554 36 H 6.3264 -3.9002 -0.2091 H 1 UNL1111111111 0.1503 37 H 8.1069 -2.2479 0.1295 H 1 UNL1111111111 0.1541 38 H -6.9974 0.7071 -0.2328 H 1 UNL1111111111 0.1814 39 H -7.0580 -0.5537 0.9991 H 1 UNL1111111111 0.1794 40 H -7.0857 -1.0905 -2.0615 H 1 UNL1111111111 0.1508 41 H -7.1701 -2.3390 -0.8227 H 1 UNL1111111111 0.1509 42 H -9.4722 -1.7657 -1.6461 H 1 UNL1111111111 0.1469 43 H -9.2521 -0.0732 -1.1934 H 1 UNL1111111111 0.1446 44 H -9.3360 -1.3218 0.0568 H 1 UNL1111111111 0.1441 @BOND 1 1 17 1 2 1 25 1 3 2 11 2 4 3 25 2 5 4 7 ar 6 4 8 ar 7 4 28 1 8 5 9 ar 9 5 12 ar 10 5 29 1 11 6 8 ar 12 6 10 ar 13 6 15 ar 14 7 10 ar 15 7 11 1 16 8 16 ar 17 9 11 1 18 9 14 ar 19 10 27 1 20 12 13 ar 21 12 19 ar 22 13 14 ar 23 13 20 ar 24 14 30 1 25 15 17 ar 26 15 31 1 27 16 18 ar 28 16 32 1 29 17 18 ar 30 18 33 1 31 19 21 ar 32 19 34 1 33 20 22 ar 34 20 35 1 35 21 22 ar 36 21 36 1 37 22 37 1 38 23 24 1 39 23 25 1 40 23 38 1 41 23 39 1 42 24 26 1 43 24 40 1 44 24 41 1 45 26 42 1 46 26 43 1 47 26 44 1