0 mol 0 unq 0 iso 0 dist 9.19007 7.02374 7.92928 12.4853 11.2254 5.75315 numMergedOcc 0
1 mol 0 unq 1 iso 0 dist 6.26831 10.3034 7.48645 11.8368 6.90471 5.75315 numMergedOcc 0
2 mol 7 unq 0 iso 0 dist 5.72491 10.515 7.45262 9.67164 8.0744 8.81608 numMergedOcc 0
3 mol 7 unq 1 iso 0 dist 7.88043 6.06176 7.45262 5.99459 8.0744 8.81608 numMergedOcc 0
4 mol 7 unq 2 iso 0 dist 8.80762 6.06176 6.96586 5.99459 11.7002 8.81608 numMergedOcc 0
5 mol 9 unq 0 iso 0 dist 7.05346 13.5628 9.82483 12.8359 8.17486 9.81658 numMergedOcc 0
6 mol 13 unq 0 iso 0 dist 5.78148 11.1987 9.11447 11.3637 8.85788 7.98465 numMergedOcc 0
7 mol 13 unq 1 iso 0 dist 6.26071 12.0488 9.11447 14.5332 8.85788 7.98465 numMergedOcc 0
8 mol 13 unq 2 iso 0 dist 8.43325 14.2112 9.11447 16.871 8.85788 7.98465 numMergedOcc 0
9 mol 25 unq 0 iso 0 dist 6.6492 4.70708 8.5404 9.49421 11.7199 8.53931 numMergedOcc 0
10 mol 56 unq 0 iso 0 dist 6.77886 10.9467 5.86571 15.5626 9.20886 9.35784 numMergedOcc 0
11 mol 119 unq 0 iso 0 dist 7.99857 6.35763 9.87025 6.99446 6.29394 6.13374 numMergedOcc 0
12 mol 119 unq 1 iso 0 dist 7.99857 7.36192 5.85818 11.2897 6.71103 6.55202 numMergedOcc 0
13 mol 119 unq 2 iso 0 dist 7.99857 7.36192 5.85818 6.99446 6.29394 9.08536 numMergedOcc 0
14 mol 119 unq 3 iso 0 dist 8.56342 10.0197 9.87025 7.64052 6.29394 6.13374 numMergedOcc 0
15 mol 119 unq 4 iso 0 dist 8.56342 10.6679 5.85818 12.31 6.71103 6.55202 numMergedOcc 0
16 mol 119 unq 5 iso 0 dist 8.56342 10.6679 5.85818 7.64052 6.29394 9.08536 numMergedOcc 0
17 mol 130 unq 0 iso 0 dist 8.33077 8.84655 6.42785 13.7122 5.77497 8.9677 numMergedOcc 0
18 mol 130 unq 1 iso 0 dist 9.28592 10.3933 6.82089 18.4303 12.7192 8.9677 numMergedOcc 0
19 mol 143 unq 0 iso 0 dist 8.41611 5.44503 6.40901 7.36975 9.05786 8.18023 numMergedOcc 0
20 mol 143 unq 1 iso 0 dist 8.41611 5.44503 6.40901 5.40637 6.16103 7.46803 numMergedOcc 0
21 mol 143 unq 2 iso 0 dist 7.63338 6.01455 8.1582 7.36975 3.75378 7.05845 numMergedOcc 0
22 mol 143 unq 3 iso 0 dist 7.63338 5.44503 9.40626 7.36975 3.75378 8.18023 numMergedOcc 0
23 mol 143 unq 4 iso 0 dist 7.63338 5.44503 9.40626 5.40637 8.4697 7.46803 numMergedOcc 0
24 mol 143 unq 5 iso 0 dist 7.25673 6.01455 7.88655 7.36975 9.30534 7.05845 numMergedOcc 0
25 mol 175 unq 0 iso 0 dist 7.35824 11.1651 7.01126 19.1978 15.0659 9.76114 numMergedOcc 0
26 mol 175 unq 1 iso 0 dist 9.17364 11.1651 6.58434 19.1978 10.6405 9.76114 numMergedOcc 0
27 mol 184 unq 0 iso 0 dist 8.77887 6.47974 6.21206 6.73504 6.19242 7.59939 numMergedOcc 0
28 mol 195 unq 0 iso 0 dist 6.60567 13.6975 9.79691 14.4992 8.68163 9.32333 numMergedOcc 0
29 mol 195 unq 1 iso 0 dist 7.62942 6.08211 9.79691 11.8893 8.68163 9.32333 numMergedOcc 0
30 mol 210 unq 0 iso 0 dist 7.63018 10.9823 6.4829 14.5885 7.93147 6.49938 numMergedOcc 0
31 mol 210 unq 1 iso 0 dist 7.63018 10.9823 6.4829 15.3681 9.86049 5.87339 numMergedOcc 0
32 mol 214 unq 0 iso 0 dist 7.05523 7.62375 7.2498 16.026 11.6757 9.58372 numMergedOcc 0
33 mol 214 unq 1 iso 0 dist 6.38157 6.67959 5.10114 7.46481 5.73082 8.70987 numMergedOcc 0
34 mol 214 unq 2 iso 0 dist 8.46327 10.7373 7.2498 13.9627 11.6757 9.58372 numMergedOcc 0
35 mol 218 unq 0 iso 0 dist 6.29367 8.36122 6.61099 11.5084 13.0451 8.61306 numMergedOcc 0
36 mol 218 unq 1 iso 0 dist 8.06216 7.47048 9.67381 9.24601 13.7733 8.61306 numMergedOcc 0
37 mol 218 unq 2 iso 0 dist 5.76954 7.47048 6.61099 9.24601 13.0451 8.61306 numMergedOcc 0
38 mol 218 unq 3 iso 0 dist 9.20961 12.7963 6.61099 13.6075 13.0451 8.61306 numMergedOcc 0
39 mol 225 unq 0 iso 0 dist 9.18895 9.60485 7.95883 16.2205 16.563 8.91356 numMergedOcc 0
40 mol 225 unq 1 iso 0 dist 9.18895 9.60485 7.95883 19.1321 14.369 9.57455 numMergedOcc 0
41 mol 225 unq 2 iso 0 dist 6.6561 8.69249 5.13453 6.50998 6.35462 8.91356 numMergedOcc 0
42 mol 225 unq 3 iso 0 dist 6.6561 8.69249 5.13453 11.7112 5.72293 9.57455 numMergedOcc 0
43 mol 227 unq 0 iso 0 dist 8.03442 6.43754 7.1372 9.91384 11.2819 7.79951 numMergedOcc 0
44 mol 238 unq 0 iso 0 dist 5.52379 11.6239 7.61203 8.63015 8.5378 7.39547 numMergedOcc 0
45 mol 238 unq 1 iso 0 dist 5.52379 5.54325 6.89694 6.99888 5.63944 5.43613 numMergedOcc 0
46 mol 238 unq 2 iso 0 dist 5.52379 5.54325 6.89694 8.63015 8.5378 7.24334 numMergedOcc 0
47 mol 238 unq 3 iso 0 dist 5.64181 10.4664 8.6597 9.7696 4.14399 9.38131 numMergedOcc 0
48 mol 238 unq 4 iso 0 dist 5.64181 11.2717 7.47235 9.7696 4.14399 6.85253 numMergedOcc 0
49 mol 238 unq 5 iso 0 dist 5.64181 5.17471 6.44735 9.08509 6.94907 5.43613 numMergedOcc 0
50 mol 238 unq 6 iso 0 dist 5.64181 5.17471 6.44735 10.1172 11.4389 7.24334 numMergedOcc 0
51 mol 238 unq 7 iso 0 dist 5.64181 5.03393 5.91208 12.47 9.58024 9.82327 numMergedOcc 0
52 mol 238 unq 8 iso 0 dist 5.64181 5.03393 5.91208 9.08509 6.94907 7.06768 numMergedOcc 0
53 mol 238 unq 9 iso 0 dist 5.64181 5.03393 5.91208 9.7696 4.14399 9.08687 numMergedOcc 0
54 mol 238 unq 10 iso 0 dist 7.61393 13.3539 8.6597 10.0682 4.14399 9.38131 numMergedOcc 0
55 mol 238 unq 11 iso 0 dist 7.61393 14.7509 7.47235 10.0682 4.14399 6.85253 numMergedOcc 0
56 mol 238 unq 12 iso 0 dist 7.61393 10.7999 6.44735 11.9549 6.94907 5.43613 numMergedOcc 0
57 mol 238 unq 13 iso 0 dist 7.61393 10.7999 6.44735 16.782 11.4389 7.24334 numMergedOcc 0
58 mol 238 unq 14 iso 0 dist 7.61393 5.49433 5.91208 14.4629 9.58024 9.82327 numMergedOcc 0
59 mol 238 unq 15 iso 0 dist 7.61393 5.49433 5.91208 11.9549 6.94907 7.06768 numMergedOcc 0
60 mol 238 unq 16 iso 0 dist 7.61393 5.49433 5.91208 10.0682 4.14399 9.08687 numMergedOcc 0
61 mol 248 unq 0 iso 0 dist 6.77954 5.59351 8.42446 10.9541 8.10311 8.07962 numMergedOcc 0
62 mol 248 unq 1 iso 0 dist 6.17052 6.48757 8.53148 9.05018 7.14182 5.0345 numMergedOcc 0
63 mol 248 unq 2 iso 0 dist 9.77666 5.51827 8.53148 9.33962 7.14182 5.0345 numMergedOcc 0
64 mol 259 unq 0 iso 0 dist 8.55558 5.79468 6.39918 11.7465 4.67584 8.84648 numMergedOcc 0
65 mol 259 unq 1 iso 0 dist 8.55558 5.79468 6.39918 5.85442 7.32929 6.23661 numMergedOcc 0
66 mol 259 unq 2 iso 0 dist 8.59697 5.31048 6.39918 8.03219 4.67584 8.84648 numMergedOcc 0
67 mol 259 unq 3 iso 0 dist 8.59697 5.31048 6.39918 6.9899 7.32929 6.23661 numMergedOcc 0
68 mol 272 unq 0 iso 0 dist 9.05222 5.7074 7.35433 11.5372 3.79986 9.19905 numMergedOcc 0
