0 mol 19 unq 0 iso 0 dist 4.51865 8.58657 6.74265 6.41423 4.64838 5.90856 7.7312 4.44441 9.61438 5.31883 numMergedOcc 0
1 mol 19 unq 1 iso 0 dist 6.864 8.58657 5.5841 6.41423 4.97119 5.90856 7.7312 10.0411 9.61438 5.31883 numMergedOcc 0
2 mol 24 unq 0 iso 0 dist 6.86014 9.75144 5.39241 7.33768 4.32034 5.90981 7.49157 8.66248 6.72423 7.02381 numMergedOcc 0
3 mol 24 unq 1 iso 0 dist 6.86014 9.75144 5.39241 7.33768 4.32034 5.90981 7.73794 6.73521 4.0664 7.18485 numMergedOcc 0
4 mol 24 unq 2 iso 0 dist 6.86014 9.75144 5.39241 9.01567 8.67951 13.2265 7.49157 8.66248 6.72423 13.4969 numMergedOcc 0
5 mol 24 unq 3 iso 0 dist 6.86014 9.75144 5.39241 9.01567 8.67951 13.2265 7.73794 6.73521 4.0664 13.9252 numMergedOcc 0
6 mol 24 unq 4 iso 0 dist 6.86014 9.75144 5.39241 7.29868 8.52463 13.719 7.49157 8.66248 6.72423 14.1137 numMergedOcc 0
7 mol 24 unq 5 iso 0 dist 6.86014 9.75144 5.39241 7.29868 8.52463 13.719 7.73794 6.73521 4.0664 13.4584 numMergedOcc 0
8 mol 25 unq 0 iso 0 dist 7.31767 7.685 8.43188 8.6653 5.64303 12.9735 7.03372 7.23535 4.60034 10.3493 numMergedOcc 0
9 mol 25 unq 1 iso 0 dist 6.03987 7.685 10.3635 8.6653 5.82503 12.9735 7.03372 9.92243 4.60034 10.3493 numMergedOcc 0
10 mol 43 unq 0 iso 0 dist 8.80331 9.83618 10.4442 8.95682 6.18002 4.54282 9.02471 12.6657 10.4465 10.4863 numMergedOcc 0
11 mol 43 unq 1 iso 0 dist 6.20293 9.83618 9.49077 8.95682 8.38399 4.54282 9.02471 14.0654 10.4465 10.4863 numMergedOcc 0
12 mol 52 unq 0 iso 0 dist 9.80098 7.18176 5.93337 6.31696 11.6682 6.29814 6.22221 8.88455 6.35905 5.88357 numMergedOcc 0
13 mol 52 unq 1 iso 0 dist 7.34143 7.18176 4.5482 6.31696 6.66056 6.29814 6.22221 9.53385 6.35905 5.88357 numMergedOcc 0
14 mol 58 unq 0 iso 0 dist 6.81627 8.26899 5.98837 7.21955 7.09066 10.8421 9.4278 7.93183 13.4402 4.97525 numMergedOcc 0
15 mol 58 unq 1 iso 0 dist 7.32874 8.26899 4.55117 7.21955 7.12541 10.8421 9.4278 10.7675 13.4402 4.97525 numMergedOcc 0
16 mol 58 unq 2 iso 0 dist 6.86465 8.63333 6.47744 9.92355 5.78774 12.0055 9.23438 4.59417 4.43437 8.76454 numMergedOcc 0
17 mol 58 unq 3 iso 0 dist 6.35756 8.89374 6.47744 7.68678 5.78774 12.0055 7.17488 4.59417 4.43437 8.76454 numMergedOcc 0
18 mol 58 unq 4 iso 0 dist 9.55426 8.26899 10.3782 7.21955 5.74871 10.8421 9.4278 10.5901 13.4402 4.97525 numMergedOcc 0
19 mol 72 unq 0 iso 0 dist 8.8178 6.77912 12.0644 9.27838 15.434 4.67641 4.86198 5.21565 10.4337 13.6186 numMergedOcc 0
20 mol 72 unq 1 iso 0 dist 9.96708 6.77912 7.11552 9.27838 11.6378 4.67641 4.86198 10.7434 10.4337 13.6186 numMergedOcc 0
21 mol 92 unq 0 iso 0 dist 9.33898 8.36431 10.9701 8.91313 17.5889 10.2475 8.85601 17.4771 11.3487 4.17255 numMergedOcc 0
22 mol 92 unq 1 iso 0 dist 9.33898 8.36431 10.9701 8.16392 10.8304 6.94695 8.85601 17.4771 11.3487 9.96839 numMergedOcc 0
23 mol 92 unq 2 iso 0 dist 9.64443 8.36431 12.4284 8.91313 13.3881 10.2475 8.85601 10.2467 11.3487 4.17255 numMergedOcc 0
24 mol 92 unq 3 iso 0 dist 9.64443 8.36431 12.4284 8.16392 5.90097 6.94695 8.85601 10.2467 11.3487 9.96839 numMergedOcc 0
25 mol 114 unq 0 iso 0 dist 7.5732 8.71128 5.80557 6.84011 7.436 9.23527 9.93438 6.25685 5.80637 5.99273 numMergedOcc 0
26 mol 131 unq 0 iso 0 dist 6.85062 6.91348 6.19596 8.70296 14.2045 9.93183 8.80895 11.6692 6.25029 5.92118 numMergedOcc 0
27 mol 131 unq 1 iso 0 dist 6.85062 6.91348 6.19596 9.25558 5.09131 5.90177 8.80895 11.6692 6.25029 10.2176 numMergedOcc 0
28 mol 131 unq 2 iso 0 dist 6.85062 9.51418 6.6499 8.70296 14.2045 16.5048 8.80895 11.6692 13.4297 5.92118 numMergedOcc 0
29 mol 131 unq 3 iso 0 dist 6.85062 9.51418 6.6499 9.25558 5.09131 5.70899 8.80895 11.6692 13.4297 10.2176 numMergedOcc 0
30 mol 175 unq 0 iso 0 dist 9.29945 9.52634 9.11521 9.39352 7.27408 7.60254 9.19156 13.8965 16.559 11.8094 numMergedOcc 0
31 mol 181 unq 0 iso 0 dist 7.81386 7.98142 9.53462 5.94469 7.77758 8.93991 8.29467 6.13927 9.55459 3.63671 numMergedOcc 0
32 mol 181 unq 1 iso 0 dist 7.81386 7.37327 11.1462 5.94469 7.77758 5.35588 8.29467 6.13927 7.66761 3.63671 numMergedOcc 0
33 mol 181 unq 2 iso 0 dist 7.63312 7.98142 9.60512 5.94469 12.5387 8.93991 8.29467 13.2274 9.55459 3.63671 numMergedOcc 0
34 mol 181 unq 3 iso 0 dist 7.63312 7.37327 13.3389 5.94469 12.5387 5.35588 8.29467 13.2274 7.66761 3.63671 numMergedOcc 0
35 mol 222 unq 0 iso 0 dist 8.01589 6.82208 4.8892 7.67576 10.3151 7.39748 5.1609 6.91863 3.72064 3.98604 numMergedOcc 0
36 mol 222 unq 1 iso 0 dist 8.01589 6.82208 4.8892 9.82371 8.52017 5.08928 5.1609 6.91863 3.72064 7.99695 numMergedOcc 0
37 mol 222 unq 2 iso 0 dist 7.7699 6.82208 11.0074 7.67576 7.81022 7.39748 5.1609 8.26703 3.72064 3.98604 numMergedOcc 0
38 mol 222 unq 3 iso 0 dist 7.7699 6.82208 11.0074 9.82371 15.7504 5.08928 5.1609 8.26703 3.72064 7.99695 numMergedOcc 0
39 mol 222 unq 4 iso 0 dist 7.21333 6.82208 12.2813 7.67576 7.75656 7.39748 5.1609 8.89157 3.72064 3.98604 numMergedOcc 0
40 mol 222 unq 5 iso 0 dist 7.21333 6.82208 12.2813 9.82371 16.0949 5.08928 5.1609 8.89157 3.72064 7.99695 numMergedOcc 0
41 mol 235 unq 0 iso 0 dist 5.4638 9.58736 9.66021 9.55668 7.60081 13.128 8.08965 4.75609 14.2299 6.82702 numMergedOcc 0
