@MOLECULE (2s)-1-(trifluoroacetyl)-2-pyrrolidinecarboxylic anhydride 41 42 0 0 0 SMALL GASTEIGER @ATOM 1 F 6.2778 0.4927 0.3768 F 1 UNL1111111111 -0.0162 2 F -6.2791 -0.4845 0.3841 F 1 UNL1111111111 -0.0232 3 F 5.4431 -1.1114 1.4711 F 1 UNL1111111111 0.0226 4 F 6.2586 -1.4364 -0.4629 F 1 UNL1111111111 0.0249 5 F -5.4386 1.1229 1.4670 F 1 UNL1111111111 0.0172 6 F -6.2544 1.4404 -0.4665 F 1 UNL1111111111 0.0181 7 O -0.0005 -0.0037 -0.5090 O.3 1 UNL1111111111 -0.2286 8 O -1.3554 -0.0605 1.3027 O.2 1 UNL1111111111 -0.2096 9 O 1.3604 0.0502 1.2992 O.2 1 UNL1111111111 -0.2072 10 O -3.6136 1.3926 -0.8897 O.2 1 UNL1111111111 -0.2766 11 O 3.6134 -1.3930 -0.8889 O.2 1 UNL1111111111 -0.2859 12 N -3.5049 -0.8014 -0.4032 N.am 1 UNL1111111111 -0.0901 13 N 3.5059 0.8010 -0.4067 N.am 1 UNL1111111111 -0.1120 14 C 2.1207 0.8889 -0.8946 C.3 1 UNL1111111111 -0.1803 15 C -2.1230 -0.8928 -0.8914 C.3 1 UNL1111111111 -0.2706 16 C 1.8309 2.3973 -1.0084 C.3 1 UNL1111111111 -0.3764 17 C -1.8378 -2.4006 -1.0117 C.3 1 UNL1111111111 -0.3065 18 C 2.7733 3.0557 0.0140 C.3 1 UNL1111111111 -0.4310 19 C -2.7780 -3.0590 0.0121 C.3 1 UNL1111111111 -0.5080 20 C 3.9454 2.0679 0.2088 C.3 1 UNL1111111111 -0.3002 21 C -3.9483 -2.0694 0.2121 C.3 1 UNL1111111111 -0.2141 22 C -1.1749 -0.2878 0.1488 C.2 1 UNL1111111111 0.2800 23 C 1.1752 0.2816 0.1464 C.2 1 UNL1111111111 0.2623 24 C 4.1189 -0.4146 -0.3859 C.2 1 UNL1111111111 0.3347 25 C -4.1193 0.4134 -0.3873 C.2 1 UNL1111111111 0.3038 26 C -5.5215 0.5977 0.2519 C.3 1 UNL1111111111 -0.1846 27 C 5.5232 -0.5943 0.2516 C.3 1 UNL1111111111 -0.2123 28 H 2.0140 0.3443 -1.8719 H 1 UNL1111111111 0.2370 29 H -2.0172 -0.3457 -1.8679 H 1 UNL1111111111 0.2566 30 H -0.7767 -2.6434 -0.8215 H 1 UNL1111111111 0.2114 31 H -2.0498 -2.7557 -2.0366 H 1 UNL1111111111 0.2140 32 H 0.7697 2.6367 -0.8128 H 1 UNL1111111111 0.2232 33 H 2.0387 2.7563 -2.0333 H 1 UNL1111111111 0.2233 34 H 3.1279 4.0391 -0.3344 H 1 UNL1111111111 0.2103 35 H 2.2502 3.2346 0.9718 H 1 UNL1111111111 0.2303 36 H -3.1361 -4.0407 -0.3380 H 1 UNL1111111111 0.2224 37 H -2.2535 -3.2419 0.9684 H 1 UNL1111111111 0.2439 38 H 4.1751 1.9230 1.2868 H 1 UNL1111111111 0.2298 39 H 4.8573 2.4397 -0.3078 H 1 UNL1111111111 0.2388 40 H -4.1784 -1.9282 1.2900 H 1 UNL1111111111 0.2113 41 H -4.8622 -2.4373 -0.3025 H 1 UNL1111111111 0.2175 @BOND 1 1 27 1 2 2 26 1 3 3 27 1 4 4 27 1 5 5 26 1 6 6 26 1 7 7 22 1 8 7 23 1 9 8 22 2 10 9 23 2 11 10 25 2 12 11 24 2 13 12 15 1 14 12 21 1 15 12 25 am 16 13 14 1 17 13 20 1 18 13 24 am 19 14 16 1 20 14 23 1 21 14 28 1 22 15 17 1 23 15 22 1 24 15 29 1 25 16 18 1 26 16 32 1 27 16 33 1 28 17 19 1 29 17 30 1 30 17 31 1 31 18 20 1 32 18 34 1 33 18 35 1 34 19 21 1 35 19 36 1 36 19 37 1 37 20 38 1 38 20 39 1 39 21 40 1 40 21 41 1 41 24 27 1 42 25 26 1