0 mol 7 unq 0 iso 0 dist 8.94874 8.36111 5.07985 17.4437 13.2513 9.87885 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 8.94874 8.36111 5.07985 5.77391 7.21217 6.1206 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 8.94874 5.99898 6.83196 5.77391 7.21217 7.67927 numMergedOcc 0
3 mol 72 unq 0 iso 0 dist 8.71615 8.16985 11.9225 10.1721 15.6984 9.74228 numMergedOcc 0
4 mol 72 unq 1 iso 0 dist 8.71615 8.16985 11.9225 11.6369 15.4232 7.12321 numMergedOcc 0
5 mol 72 unq 2 iso 0 dist 8.71615 8.16985 11.9225 6.12361 13.8194 6.21799 numMergedOcc 0
6 mol 72 unq 3 iso 0 dist 8.71615 7.81344 13.3667 6.12361 13.8194 5.03251 numMergedOcc 0
7 mol 72 unq 4 iso 0 dist 8.71615 7.81344 13.3667 11.4334 19.4622 9.56773 numMergedOcc 0
8 mol 72 unq 5 iso 0 dist 8.71615 5.49421 8.89293 6.12361 13.8194 7.66093 numMergedOcc 0
9 mol 76 unq 0 iso 0 dist 7.71596 9.78762 8.66335 10.2292 12.3244 8.23026 numMergedOcc 0
10 mol 112 unq 0 iso 0 dist 9.37708 7.77418 5.96497 6.95852 9.67907 5.56994 numMergedOcc 0
11 mol 117 unq 0 iso 0 dist 5.24519 8.54233 6.66127 5.34484 7.70533 6.10127 numMergedOcc 0
12 mol 142 unq 0 iso 0 dist 9.5355 5.90339 9.23267 8.68855 7.57458 7.81207 numMergedOcc 0
13 mol 142 unq 1 iso 0 dist 9.5355 5.90339 9.23267 5.50176 10.5524 6.14151 numMergedOcc 0
14 mol 184 unq 0 iso 0 dist 5.13722 9.07247 10.6375 7.25468 11.3917 5.96423 numMergedOcc 0
15 mol 186 unq 0 iso 0 dist 8.40343 7.12029 8.06464 6.94867 14.3315 8.90571 numMergedOcc 0
16 mol 186 unq 1 iso 0 dist 8.40343 7.12029 8.06464 5.77884 11.1735 6.61112 numMergedOcc 0
17 mol 207 unq 0 iso 0 dist 4.55528 8.01415 4.43093 5.62653 5.08312 5.12567 numMergedOcc 0
18 mol 207 unq 1 iso 0 dist 4.55528 8.25861 5.15938 4.4545 8.09522 9.98372 numMergedOcc 0
19 mol 207 unq 2 iso 0 dist 4.55528 8.25861 5.15938 5.62653 5.08312 6.0563 numMergedOcc 0
20 mol 207 unq 3 iso 0 dist 4.55528 8.5067 7.6274 4.4545 8.09522 9.1528 numMergedOcc 0
21 mol 207 unq 4 iso 0 dist 4.55528 8.5067 7.6274 5.62653 5.08312 8.1244 numMergedOcc 0
22 mol 214 unq 0 iso 0 dist 5.69733 6.91906 4.112 5.68711 8.49704 7.46481 numMergedOcc 0
23 mol 224 unq 0 iso 0 dist 9.92947 5.88041 15.6142 13.1803 22.9005 8.08349 numMergedOcc 0
24 mol 224 unq 1 iso 0 dist 9.92947 5.88041 15.6142 10.3321 18.4044 9.78218 numMergedOcc 0
25 mol 224 unq 2 iso 0 dist 7.46044 5.88041 3.56689 13.1803 9.75313 8.08349 numMergedOcc 0
26 mol 224 unq 3 iso 0 dist 7.46044 5.88041 3.56689 10.3321 11.1179 9.78218 numMergedOcc 0
27 mol 224 unq 4 iso 0 dist 8.68767 5.31916 7.57013 8.98459 11.9715 6.99769 numMergedOcc 0
28 mol 224 unq 5 iso 0 dist 8.68767 5.31916 7.57013 9.81806 15.9877 8.79428 numMergedOcc 0
29 mol 224 unq 6 iso 0 dist 8.68767 5.31916 7.57013 5.99647 12.7282 6.8692 numMergedOcc 0
30 mol 235 unq 0 iso 0 dist 7.52696 6.50932 5.39025 14.2513 10.5214 8.19317 numMergedOcc 0
31 mol 235 unq 1 iso 0 dist 7.52696 6.50932 5.39025 8.38435 7.2346 5.1823 numMergedOcc 0
32 mol 259 unq 0 iso 0 dist 7.4294 6.95658 12.6734 5.20592 10.3594 9.07743 numMergedOcc 0
33 mol 259 unq 1 iso 0 dist 7.4294 6.95658 12.6734 6.80302 13.8212 7.66153 numMergedOcc 0
34 mol 259 unq 2 iso 0 dist 8.37253 6.95658 5.77768 5.20592 12.6542 9.07743 numMergedOcc 0
35 mol 259 unq 3 iso 0 dist 8.37253 6.95658 5.77768 6.80302 12.3765 7.66153 numMergedOcc 0
36 mol 273 unq 0 iso 0 dist 9.36052 8.28809 6.08276 6.69098 12.8035 9.59325 numMergedOcc 0
37 mol 274 unq 0 iso 0 dist 9.30966 9.40401 13.3483 11.1036 13.6339 9.30212 numMergedOcc 0
38 mol 274 unq 1 iso 0 dist 5.38704 9.40401 7.5856 11.1036 10.3428 9.30212 numMergedOcc 0
39 mol 274 unq 2 iso 0 dist 8.05503 9.40401 5.04738 11.1036 12.9668 9.30212 numMergedOcc 0
40 mol 274 unq 3 iso 0 dist 8.26695 5.64169 7.5856 11.5127 10.3428 9.30212 numMergedOcc 0
41 mol 274 unq 4 iso 0 dist 5.59151 5.64169 5.04738 11.5127 12.9668 9.30212 numMergedOcc 0
42 mol 274 unq 5 iso 0 dist 8.17922 5.64169 12.0951 11.5127 17.1941 9.30212 numMergedOcc 0
43 mol 276 unq 0 iso 0 dist 7.35537 7.70127 5.58312 9.58401 9.05218 8.6759 numMergedOcc 0
44 mol 280 unq 0 iso 0 dist 9.047 6.16546 12.331 8.30978 16.7212 6.02353 numMergedOcc 0
45 mol 280 unq 1 iso 0 dist 9.047 6.16546 12.331 5.80223 13.1827 6.86234 numMergedOcc 0
46 mol 280 unq 2 iso 0 dist 9.9227 6.16546 7.42656 8.30978 11.1402 6.02353 numMergedOcc 0
47 mol 280 unq 3 iso 0 dist 9.9227 6.16546 7.42656 5.80223 8.85762 6.86234 numMergedOcc 0
48 mol 284 unq 0 iso 0 dist 8.38071 9.02411 7.00626 6.5173 12.2153 9.19921 numMergedOcc 0
49 mol 284 unq 1 iso 0 dist 8.38071 9.02411 7.00626 6.535 10.8092 6.41303 numMergedOcc 0
50 mol 284 unq 2 iso 0 dist 7.80784 9.02411 6.34668 6.5173 11.8622 9.19921 numMergedOcc 0
51 mol 284 unq 3 iso 0 dist 7.80784 9.02411 6.34668 6.535 8.42412 6.41303 numMergedOcc 0
