0 mol 7 unq 0 iso 0 dist 8.41585 6.36911 6.06176 9.87885 12.8323 7.92429 12.0193 5.99972 10.6471 14.8356 numMergedOcc 0
1 mol 7 unq 1 iso 0 dist 7.10621 7.31201 10.789 6.1206 7.12508 4.40641 13.8829 8.72114 13.6379 11.2901 numMergedOcc 0
2 mol 7 unq 2 iso 0 dist 7.10621 7.31201 10.789 7.67927 11.143 5.03278 13.8829 8.72114 13.6379 16.0449 numMergedOcc 0
3 mol 7 unq 3 iso 0 dist 7.10621 9.36807 10.515 6.1206 7.12508 7.92429 13.8829 8.72114 9.97624 11.2901 numMergedOcc 0
4 mol 7 unq 4 iso 0 dist 7.10621 9.36807 10.515 7.67927 11.143 11.2233 13.8829 8.72114 9.97624 16.0449 numMergedOcc 0
5 mol 9 unq 0 iso 0 dist 8.57077 8.47421 5.60154 8.55451 8.69454 5.66192 9.5997 9.62394 9.57198 14.126 numMergedOcc 0
6 mol 9 unq 1 iso 0 dist 8.57077 8.47421 5.60154 5.8245 5.84314 3.91075 9.5997 9.62394 9.57198 10.9352 numMergedOcc 0
7 mol 16 unq 0 iso 0 dist 5.05803 7.03948 6.2983 6.42835 5.01101 9.87867 5.30082 6.93532 11.7521 5.94982 numMergedOcc 0
8 mol 16 unq 1 iso 0 dist 5.05803 7.03948 6.2983 6.57331 4.65873 4.68733 5.30082 6.93532 11.7521 10.0132 numMergedOcc 0
9 mol 16 unq 2 iso 0 dist 6.31718 5.47769 6.2983 8.43054 4.65873 4.68733 10.4366 6.93532 11.7521 10.0132 numMergedOcc 0
10 mol 25 unq 0 iso 0 dist 6.03987 7.685 10.3635 7.6114 5.86705 7.1845 5.68392 6.85556 9.71382 6.29797 numMergedOcc 0
11 mol 58 unq 0 iso 0 dist 7.32874 6.40841 6.75888 8.69057 5.61579 11.0945 7.12541 7.21955 8.71468 10.4354 numMergedOcc 0
12 mol 58 unq 1 iso 0 dist 6.62496 9.64665 4.67832 9.22598 9.87158 8.59939 9.95364 8.80614 10.4309 9.01564 numMergedOcc 0
13 mol 58 unq 2 iso 0 dist 6.35756 8.89374 6.47744 8.96727 9.87158 14.6599 5.49591 8.80614 9.11258 9.01564 numMergedOcc 0
14 mol 58 unq 3 iso 0 dist 6.35756 8.89374 6.47744 8.01308 5.86526 9.47022 5.49591 8.80614 9.11258 7.11065 numMergedOcc 0
15 mol 64 unq 0 iso 0 dist 9.67592 8.68586 5.3948 9.86334 5.16015 8.84224 6.21578 9.97159 9.32552 12.5444 numMergedOcc 0
16 mol 72 unq 0 iso 0 dist 9.96708 7.321 9.0131 9.55118 5.69391 6.74416 11.6378 9.27838 13.1462 7.58875 numMergedOcc 0
17 mol 72 unq 1 iso 0 dist 9.96708 7.321 9.0131 9.10345 13.4212 5.63793 11.6378 9.27838 13.1462 14.0067 numMergedOcc 0
18 mol 73 unq 0 iso 0 dist 9.96396 8.70133 7.41074 9.73086 5.70116 6.15714 5.11416 9.24757 7.10439 6.14542 numMergedOcc 0
19 mol 73 unq 1 iso 0 dist 6.19304 4.65521 7.41074 8.68662 6.20232 6.10063 6.56633 9.24757 7.10439 8.96616 numMergedOcc 0
20 mol 73 unq 2 iso 0 dist 6.19304 4.65521 7.41074 7.4369 5.70116 6.15714 6.56633 9.24757 7.10439 6.14542 numMergedOcc 0
21 mol 92 unq 0 iso 0 dist 7.4729 5.81965 6.99832 8.3773 4.46885 7.94489 9.50382 6.95572 5.39745 9.92987 numMergedOcc 0
22 mol 92 unq 1 iso 0 dist 7.4729 5.81965 6.99832 8.3773 4.46885 7.94489 12.7565 7.38677 10.8154 11.4716 numMergedOcc 0
23 mol 100 unq 0 iso 0 dist 7.47343 8.72704 10.1589 7.82475 5.9143 12.5061 12.2861 8.30845 9.44658 13.9449 numMergedOcc 0
24 mol 100 unq 1 iso 0 dist 7.47343 8.72704 10.1589 7.82475 5.9143 12.5061 15.5385 8.76378 18.5425 10.8812 numMergedOcc 0
25 mol 100 unq 2 iso 0 dist 7.47343 8.72704 10.1589 5.35782 5.47563 12.1093 12.2861 8.30845 9.44658 13.2383 numMergedOcc 0
26 mol 100 unq 3 iso 0 dist 7.47343 8.72704 10.1589 5.35782 5.47563 12.1093 15.5385 8.76378 18.5425 11.4348 numMergedOcc 0
27 mol 134 unq 0 iso 0 dist 8.94367 8.79571 5.41704 7.21868 8.06642 5.67107 4.57832 6.23142 8.73604 9.0176 numMergedOcc 0
28 mol 134 unq 1 iso 0 dist 6.37586 5.42582 5.41704 9.33924 6.95573 6.0991 5.29786 6.23142 8.73604 12.2587 numMergedOcc 0
29 mol 134 unq 2 iso 0 dist 6.37586 5.42582 5.41704 7.93372 8.06642 5.67107 5.29786 6.23142 8.73604 9.0176 numMergedOcc 0
30 mol 134 unq 3 iso 0 dist 9.86662 8.79571 6.17103 7.21868 4.00092 5.67107 4.57832 9.94764 8.73604 9.0176 numMergedOcc 0
31 mol 134 unq 4 iso 0 dist 9.71307 5.42582 6.17103 9.33924 10.2026 6.0991 5.29786 9.94764 8.73604 12.2587 numMergedOcc 0
32 mol 134 unq 5 iso 0 dist 9.71307 5.42582 6.17103 7.93372 4.00092 5.67107 5.29786 9.94764 8.73604 9.0176 numMergedOcc 0
33 mol 155 unq 0 iso 0 dist 6.43582 9.14392 12.1814 8.97626 4.91785 12.0485 5.50031 7.92304 13.3276 9.16358 numMergedOcc 0
34 mol 155 unq 1 iso 0 dist 6.43582 7.51198 6.34186 8.97626 4.91785 4.48516 5.50031 7.92304 9.80845 9.16358 numMergedOcc 0
35 mol 181 unq 0 iso 0 dist 7.81386 7.98142 9.53462 6.64173 6.8757 4.48306 7.20191 9.39829 13.5221 12.6232 numMergedOcc 0
36 mol 181 unq 1 iso 0 dist 7.81386 7.98142 9.53462 9.01624 5.71898 12.2513 7.20191 9.39829 13.5221 5.99437 numMergedOcc 0
37 mol 181 unq 2 iso 0 dist 7.81386 7.98142 9.53462 9.55105 5.83796 10.2172 7.20191 9.39829 13.5221 8.4848 numMergedOcc 0
38 mol 181 unq 3 iso 0 dist 7.81386 7.37327 11.1462 6.64173 6.8757 4.88823 7.20191 9.39829 14.5372 12.6232 numMergedOcc 0
39 mol 181 unq 4 iso 0 dist 7.81386 7.37327 11.1462 9.01624 5.71898 14.8923 7.20191 9.39829 14.5372 5.99437 numMergedOcc 0
40 mol 181 unq 5 iso 0 dist 7.81386 7.37327 11.1462 9.55105 5.83796 14.2334 7.20191 9.39829 14.5372 8.4848 numMergedOcc 0
41 mol 181 unq 6 iso 0 dist 7.63312 7.98142 9.60512 6.64173 10.6474 4.48306 5.63555 5.9176 5.97685 8.12266 numMergedOcc 0
42 mol 181 unq 7 iso 0 dist 7.63312 7.98142 9.60512 6.64173 10.6474 4.48306 7.20191 6.41453 13.5221 12.6232 numMergedOcc 0
43 mol 181 unq 8 iso 0 dist 7.63312 7.98142 9.60512 9.01624 5.93724 12.2513 5.63555 5.9176 5.97685 10.5303 numMergedOcc 0
44 mol 181 unq 9 iso 0 dist 7.63312 7.98142 9.60512 9.01624 5.93724 12.2513 7.20191 6.41453 13.5221 5.99437 numMergedOcc 0
45 mol 181 unq 10 iso 0 dist 7.63312 7.98142 9.60512 9.55105 5.12833 10.2172 5.63555 5.9176 5.97685 9.43306 numMergedOcc 0
46 mol 181 unq 11 iso 0 dist 7.63312 7.98142 9.60512 9.55105 5.12833 10.2172 7.20191 6.41453 13.5221 8.4848 numMergedOcc 0
47 mol 181 unq 12 iso 0 dist 7.63312 7.37327 13.3389 6.64173 10.6474 4.88823 5.63555 5.9176 8.9289 8.12266 numMergedOcc 0
48 mol 181 unq 13 iso 0 dist 7.63312 7.37327 13.3389 6.64173 10.6474 4.88823 7.20191 6.41453 14.5372 12.6232 numMergedOcc 0
49 mol 181 unq 14 iso 0 dist 7.63312 7.37327 13.3389 9.01624 5.93724 14.8923 5.63555 5.9176 8.9289 10.5303 numMergedOcc 0
50 mol 181 unq 15 iso 0 dist 7.63312 7.37327 13.3389 9.01624 5.93724 14.8923 7.20191 6.41453 14.5372 5.99437 numMergedOcc 0
51 mol 181 unq 16 iso 0 dist 7.63312 7.37327 13.3389 9.55105 5.12833 14.2334 5.63555 5.9176 8.9289 9.43306 numMergedOcc 0
52 mol 181 unq 17 iso 0 dist 7.63312 7.37327 13.3389 9.55105 5.12833 14.2334 7.20191 6.41453 14.5372 8.4848 numMergedOcc 0
53 mol 192 unq 0 iso 0 dist 5.59424 8.36822 5.71262 9.78634 9.53265 10.3099 8.49529 8.77999 7.33225 15.7529 numMergedOcc 0
54 mol 192 unq 1 iso 0 dist 5.59424 8.36822 5.71262 5.64942 6.35474 10.1087 8.49529 8.77999 7.33225 13.3256 numMergedOcc 0
55 mol 192 unq 2 iso 0 dist 5.59424 8.36822 5.71262 7.43054 5.25965 10.0566 8.49529 8.77999 7.33225 13.7172 numMergedOcc 0
56 mol 204 unq 0 iso 0 dist 8.51516 5.90931 12.9483 7.9133 5.57347 11.2106 5.86489 7.32294 11.641 9.48625 numMergedOcc 0
57 mol 205 unq 0 iso 0 dist 7.26832 9.19704 6.23291 6.52816 13.514 13.4094 10.3603 5.44002 10.5073 16.7889 numMergedOcc 0
58 mol 227 unq 0 iso 0 dist 7.22101 8.17891 6.43754 5.23634 5.0317 4.09934 6.35849 7.43071 12.2922 9.18728 numMergedOcc 0
59 mol 227 unq 1 iso 0 dist 7.22101 8.17891 6.43754 5.23634 5.0317 4.09934 10.9607 5.41321 7.57454 8.91971 numMergedOcc 0
60 mol 227 unq 2 iso 0 dist 8.65997 9.62609 14.6185 6.91318 5.0317 11.5454 10.204 7.43071 19.0662 9.18728 numMergedOcc 0
61 mol 227 unq 3 iso 0 dist 8.65997 9.62609 14.6185 6.91318 5.0317 11.5454 9.72615 5.41321 14.0608 8.91971 numMergedOcc 0
62 mol 227 unq 4 iso 0 dist 8.65997 6.95902 6.43754 6.91318 5.0317 4.09934 10.204 7.43071 12.2922 9.18728 numMergedOcc 0
63 mol 227 unq 5 iso 0 dist 8.65997 6.95902 6.43754 6.91318 5.0317 4.09934 9.72615 5.41321 7.57454 8.91971 numMergedOcc 0
64 mol 227 unq 6 iso 0 dist 7.09863 8.17891 9.13836 5.23634 5.83175 4.09934 6.35849 6.02296 12.2922 9.18728 numMergedOcc 0
65 mol 259 unq 0 iso 0 dist 7.88519 7.48005 11.6195 9.63573 7.20604 9.98303 8.81835 7.98231 8.71497 11.547 numMergedOcc 0
66 mol 259 unq 1 iso 0 dist 7.88519 7.48005 11.6195 7.66153 8.8603 14.0829 8.81835 7.98231 8.71497 14.6679 numMergedOcc 0
67 mol 259 unq 2 iso 0 dist 7.46176 7.48005 5.79468 9.63573 5.21606 9.98303 8.81835 7.08526 8.71497 11.547 numMergedOcc 0
68 mol 259 unq 3 iso 0 dist 7.46176 7.48005 5.79468 7.66153 11.8896 14.0829 8.81835 7.08526 8.71497 14.6679 numMergedOcc 0
