BIOGRF 321 DESCRP crco5 REMARK Created by david @ IC on 4/19/94 10:10:07 FORCEFIELD MM2 FORMAT ATOM (a6,1x,i5,1x,a5,1x,a3,1x,a1,1x,a5,3f10.5,1x,a5,i3,i2,1x,f8.5,f10.5) HETATM 1 O1 RES A 444 1.16436 1.48197 6.06299 O 3 0 0.00000 15.99900 HETATM 2 C2 RES A 444 1.59221 1.70894 5.05301 C_v 3 0 0.00000 12.00000 HETATM 3 Cr3 RES A 444 2.30426 2.10499 3.35773 Cr 3 0 0.00000 51.99600 HETATM 4 C4 RES A 444 3.02566 2.54924 1.67880 C_x 3 0 0.00000 12.00000 HETATM 5 O5 RES A 444 3.45547 2.81198 0.67837 O 3 0 0.00000 15.99900 HETATM 6 C6 RES A 444 4.04016 1.87865 4.04369 C_w 3 0 0.00000 12.00000 HETATM 7 O7 RES A 444 5.07427 1.74370 4.45206 O 3 0 0.00000 15.99900 HETATM 8 C8 RES A 444 0.56559 2.36180 2.68954 C_y 3 0 0.00000 12.00000 HETATM 9 O9 RES A 444 -0.47142 2.51132 2.29384 O 3 0 0.00000 15.99900 HETATM 10 C10 RES A 444 2.37295 3.89264 3.83113 C_z 3 0 0.00000 12.00000 HETATM 11 O11 RES A 444 2.41738 5.00343 4.12567 O 3 0 0.00000 15.99900 HETATM 12 C_3 RES A 444 2.22472 -0.16503 2.70755 P_4 4 0 0.00000 30.99400 HETATM 13 C_3 RES A 444 3.83477 -0.99522 2.65724 C_3 4 0 0.00000 8.97600 HETATM 14 HC_3 RES A 444 3.74347 -2.03238 2.26373 H__C 1 0 0.00000 1.00800 HETATM 15 HC_3 RES A 444 4.53938 -0.43858 1.99982 H__C 1 0 0.00000 1.00800 HETATM 16 HC_3 RES A 444 4.27803 -1.05347 3.67629 H__C 1 0 0.00000 1.00800 HETATM 17 C_3 RES A 444 1.61449 -0.44809 1.02552 C_3 4 0 0.00000 8.97600 HETATM 18 HC_3 RES A 444 2.27246 0.05383 0.28178 H__C 1 0 0.00000 1.00800 HETATM 19 HC_3 RES A 444 1.58680 -1.53351 0.78194 H__C 1 0 0.00000 1.00800 HETATM 20 HC_3 RES A 444 0.58799 -0.03793 0.90111 H__C 1 0 0.00000 1.00800 HETATM 21 P_4 RES A 444 1.24147 -1.32558 3.70500 C_3 4 0 0.00000 9.98400 HETATM 22 HP_4 RES A 444 1.63607 -1.31569 4.74790 H__C 1 0 0.00000 1.00800 HETATM 23 HP_4 RES A 444 1.39213 -2.35969 3.31538 H__C 1 0 0.00000 1.00800 HETATM 24 P_4 RES A 444 -0.26300 -1.02791 3.73455 C_3 4 0 0.00000 8.97600 HETATM 25 HP_4 RES A 444 -0.71500 -1.08425 2.71743 H__C 1 0 0.00000 1.00800 HETATM 26 HP_4 RES A 444 -0.79821 -1.76927 4.37279 H__C 1 0 0.00000 1.00800 HETATM 27 HP_4 RES A 444 -0.47880 -0.01771 4.15117 H__C 1 0 0.00000 1.00800 FORMAT CONECT (a6,12i6) CONECT 1 2 CONECT 2 3 1 CONECT 3 2 4 8 6 10 12 CONECT 4 3 5 CONECT 5 4 CONECT 6 3 7 CONECT 7 6 CONECT 8 9 3 CONECT 9 8 CONECT 10 11 3 CONECT 11 10 CONECT 12 3 13 17 21 CONECT 13 12 14 15 16 CONECT 14 13 CONECT 15 13 CONECT 16 13 CONECT 17 12 18 19 20 CONECT 18 17 CONECT 19 17 CONECT 20 17 CONECT 21 12 24 22 23 CONECT 22 21 CONECT 23 21 CONECT 24 21 25 26 27 CONECT 25 24 CONECT 26 24 CONECT 27 24 END