0 mol 7 unq 0 iso 0 dist 5.51421 10.6104 8.41585 4.7739 5.99459 6.88805 14.9934 14.7759 9.68596 10.3333 numMergedOcc 0
1 mol 11 unq 0 iso 0 dist 6.89666 4.73237 4.61088 6.74026 6.54358 4.10106 10.6838 6.86684 5.96346 6.859 numMergedOcc 0
2 mol 16 unq 0 iso 0 dist 9.76968 4.2139 6.31718 5.36195 8.43054 4.65873 9.68387 10.4366 6.93532 10.0132 numMergedOcc 0
3 mol 24 unq 0 iso 0 dist 6.11056 10.4744 8.86116 6.40447 8.09311 11.6226 16.6031 14.012 9.41441 19.932 numMergedOcc 0
4 mol 24 unq 1 iso 0 dist 6.11056 10.4744 8.86116 3.96014 9.05357 13.1949 16.6031 14.012 9.41441 17.7407 numMergedOcc 0
5 mol 25 unq 0 iso 0 dist 8.40051 13.466 7.57578 6.29702 4.79873 10.2864 8.78181 6.08585 8.50222 9.35791 numMergedOcc 0
6 mol 25 unq 1 iso 0 dist 8.40051 13.466 7.57578 13.591 9.48085 5.18617 8.78181 6.08585 8.50222 6.53269 numMergedOcc 0
7 mol 25 unq 2 iso 0 dist 8.40051 14.4191 7.17969 6.29702 4.79873 11.4148 8.78181 6.08585 7.55264 9.35791 numMergedOcc 0
8 mol 25 unq 3 iso 0 dist 8.40051 14.4191 7.17969 13.591 9.48085 5.68041 8.78181 6.08585 7.55264 6.53269 numMergedOcc 0
9 mol 25 unq 4 iso 0 dist 8.6396 5.8503 5.04899 10.0172 7.52933 5.03027 8.78181 5.77929 8.87757 12.7995 numMergedOcc 0
10 mol 25 unq 5 iso 0 dist 8.6396 5.8503 5.04899 5.23233 6.55597 4.69295 8.78181 5.77929 8.87757 9.16515 numMergedOcc 0
11 mol 25 unq 6 iso 0 dist 8.6396 5.8503 5.04899 13.5673 9.71956 12.2542 8.78181 5.77929 8.87757 11.5214 numMergedOcc 0
12 mol 25 unq 7 iso 0 dist 8.6396 5.8503 5.04899 10.4709 7.07751 8.79309 8.78181 5.77929 8.87757 9.82987 numMergedOcc 0
13 mol 25 unq 8 iso 0 dist 8.6396 5.8503 5.04899 12.2787 8.23761 8.17061 8.78181 5.77929 8.87757 13.3492 numMergedOcc 0
14 mol 25 unq 9 iso 0 dist 8.6396 5.8503 5.04899 13.591 9.49421 13.6145 8.78181 5.77929 8.87757 6.53269 numMergedOcc 0
15 mol 25 unq 10 iso 0 dist 7.63928 6.17631 6.03987 4.88495 7.99919 4.77954 7.05148 5.82503 8.6653 10.4755 numMergedOcc 0
16 mol 58 unq 0 iso 0 dist 6.36193 5.40367 6.62496 4.99692 9.22598 9.87158 5.84625 9.95364 8.80614 9.01564 numMergedOcc 0
17 mol 58 unq 1 iso 0 dist 4.88613 5.40367 6.35756 4.99692 8.96727 9.87158 5.84625 5.49591 8.80614 9.01564 numMergedOcc 0
18 mol 58 unq 2 iso 0 dist 4.88613 5.40367 6.35756 3.70586 8.01308 5.86526 5.84625 5.49591 8.80614 7.11065 numMergedOcc 0
19 mol 64 unq 0 iso 0 dist 8.99491 4.96726 9.67592 9.07673 9.86334 5.16015 6.23138 6.21578 9.97159 12.5444 numMergedOcc 0
20 mol 73 unq 0 iso 0 dist 6.18305 4.69583 6.19304 4.21749 8.68662 6.20232 9.54477 6.56633 9.24757 8.96616 numMergedOcc 0
21 mol 73 unq 1 iso 0 dist 6.18305 4.69583 6.19304 5.65986 7.4369 5.70116 9.54477 6.56633 9.24757 6.14542 numMergedOcc 0
22 mol 95 unq 0 iso 0 dist 9.65047 5.69671 8.03644 8.55456 9.3948 11.3215 9.49995 11.4333 9.49454 16.0499 numMergedOcc 0
23 mol 95 unq 1 iso 0 dist 9.65047 5.69671 8.03644 3.84879 9.74607 5.06946 9.49995 11.4333 9.49454 12.4483 numMergedOcc 0
24 mol 119 unq 0 iso 0 dist 6.18763 5.3154 6.18601 5.92411 8.95212 4.39676 9.34823 5.13589 6.73586 8.67537 numMergedOcc 0
25 mol 133 unq 0 iso 0 dist 5.82404 10.2385 6.29155 11.5628 8.77023 13.0405 6.72323 4.54648 6.16242 8.83732 numMergedOcc 0
26 mol 133 unq 1 iso 0 dist 5.82404 4.64588 6.80239 11.5628 8.77023 13.7612 6.72323 4.54648 5.87634 8.83732 numMergedOcc 0
27 mol 134 unq 0 iso 0 dist 9.92932 10.5108 8.94367 3.76211 7.21868 8.06642 12.1527 4.57832 6.23142 9.0176 numMergedOcc 0
28 mol 134 unq 1 iso 0 dist 9.92932 6.20443 9.86662 3.76211 7.21868 4.00092 12.1527 4.57832 9.94764 9.0176 numMergedOcc 0
29 mol 134 unq 2 iso 0 dist 9.60411 10.5108 6.37586 11.6349 9.33924 6.95573 12.1527 5.29786 6.23142 12.2587 numMergedOcc 0
30 mol 134 unq 3 iso 0 dist 9.60411 10.5108 6.37586 3.76211 7.93372 8.06642 12.1527 5.29786 6.23142 9.0176 numMergedOcc 0
31 mol 134 unq 4 iso 0 dist 9.60411 6.20443 9.71307 11.6349 9.33924 10.2026 12.1527 5.29786 9.94764 12.2587 numMergedOcc 0
32 mol 134 unq 5 iso 0 dist 9.60411 6.20443 9.71307 3.76211 7.93372 4.00092 12.1527 5.29786 9.94764 9.0176 numMergedOcc 0
33 mol 134 unq 6 iso 0 dist 9.55556 11.9294 8.94367 4.63732 7.21868 8.06642 11.9876 4.57832 6.23142 9.0176 numMergedOcc 0
34 mol 134 unq 7 iso 0 dist 9.55556 6.36794 9.86662 4.63732 7.21868 4.00092 11.9876 4.57832 9.94764 9.0176 numMergedOcc 0
35 mol 181 unq 0 iso 0 dist 9.84952 4.3158 7.81386 7.19461 6.64173 6.8757 12.7332 7.20191 9.39829 12.6232 numMergedOcc 0
36 mol 181 unq 1 iso 0 dist 9.84952 4.3158 7.81386 9.77747 9.01624 5.71898 12.7332 7.20191 9.39829 5.99437 numMergedOcc 0
37 mol 181 unq 2 iso 0 dist 9.84952 4.3158 7.81386 10.0615 9.55105 5.83796 12.7332 7.20191 9.39829 8.4848 numMergedOcc 0
38 mol 181 unq 3 iso 0 dist 9.84952 12.9554 7.63312 7.19461 6.64173 10.6474 13.401 5.63555 5.9176 8.12266 numMergedOcc 0
39 mol 181 unq 4 iso 0 dist 9.84952 12.9554 7.63312 7.19461 6.64173 10.6474 12.7332 7.20191 6.41453 12.6232 numMergedOcc 0
40 mol 181 unq 5 iso 0 dist 9.84952 12.9554 7.63312 9.77747 9.01624 5.93724 13.401 5.63555 5.9176 10.5303 numMergedOcc 0
41 mol 181 unq 6 iso 0 dist 9.84952 12.9554 7.63312 9.77747 9.01624 5.93724 12.7332 7.20191 6.41453 5.99437 numMergedOcc 0
42 mol 181 unq 7 iso 0 dist 9.84952 12.9554 7.63312 10.0615 9.55105 5.12833 13.401 5.63555 5.9176 9.43306 numMergedOcc 0
43 mol 181 unq 8 iso 0 dist 9.84952 12.9554 7.63312 10.0615 9.55105 5.12833 12.7332 7.20191 6.41453 8.4848 numMergedOcc 0
44 mol 205 unq 0 iso 0 dist 5.96555 10.7091 7.26832 6.96644 6.52816 13.514 14.6151 10.3603 5.44002 16.7889 numMergedOcc 0
45 mol 222 unq 0 iso 0 dist 7.85877 4.82768 7.21333 4.91709 5.56538 6.84862 5.89818 7.75656 7.67576 8.43195 numMergedOcc 0
46 mol 222 unq 1 iso 0 dist 7.85877 4.82768 7.21333 4.91709 5.56538 6.84862 9.32543 16.0949 9.82371 14.0832 numMergedOcc 0
47 mol 222 unq 2 iso 0 dist 7.85877 4.82768 7.21333 5.96186 7.48954 9.53117 5.89818 7.75656 7.67576 8.23406 numMergedOcc 0
48 mol 222 unq 3 iso 0 dist 7.85877 4.82768 7.21333 5.96186 7.48954 9.53117 9.32543 16.0949 9.82371 14.9425 numMergedOcc 0
49 mol 229 unq 0 iso 0 dist 8.6537 8.65216 8.22528 3.72432 7.27993 5.70473 9.38362 6.65022 8.66332 9.37336 numMergedOcc 0
50 mol 259 unq 0 iso 0 dist 5.90645 10.4985 8.13497 9.54522 9.07743 8.8603 13.1095 8.41846 7.98231 14.6679 numMergedOcc 0
