0 mol 7 unq 0 iso 0 dist 8.41585 6.36911 6.06176 9.68596 14.7759 13.0969 5.03847 10.3148 9.97624 6.14469 numMergedOcc 0
1 mol 9 unq 0 iso 0 dist 8.57077 6.85412 8.27962 9.62394 9.5997 4.45625 16.147 14.519 11.7976 7.35972 numMergedOcc 0
2 mol 9 unq 1 iso 0 dist 8.57077 6.85412 8.27962 9.62394 9.5997 4.45625 19.4709 18.1148 13.8392 9.93542 numMergedOcc 0
3 mol 9 unq 2 iso 0 dist 8.57077 6.33889 11.4878 9.62394 9.5997 6.0397 16.147 14.519 11.6997 7.35972 numMergedOcc 0
4 mol 9 unq 3 iso 0 dist 8.57077 6.33889 11.4878 9.62394 9.5997 6.0397 19.4709 18.1148 14.5309 9.93542 numMergedOcc 0
5 mol 15 unq 0 iso 0 dist 8.38064 8.21493 5.90976 7.07399 4.29582 6.33828 4.39605 7.48342 10.0974 6.03257 numMergedOcc 0
6 mol 19 unq 0 iso 0 dist 7.20519 8.78293 5.31524 7.75618 4.96411 6.2337 4.97119 10.741 13.1234 9.95212 numMergedOcc 0
7 mol 19 unq 1 iso 0 dist 7.20519 8.23643 11.0832 7.75618 4.96411 14.4867 4.97119 10.741 11.3136 9.95212 numMergedOcc 0
8 mol 19 unq 2 iso 0 dist 7.20519 7.82528 10.4988 7.75618 4.96411 11.4087 4.97119 10.741 5.82366 9.95212 numMergedOcc 0
9 mol 19 unq 3 iso 0 dist 8.4674 6.20943 5.14627 8.40416 9.74255 11.4087 4.64838 6.41575 5.82366 9.95212 numMergedOcc 0
10 mol 19 unq 4 iso 0 dist 4.54938 8.78293 10.9543 7.75618 9.74255 6.2337 4.97119 6.41575 13.1234 9.95212 numMergedOcc 0
11 mol 19 unq 5 iso 0 dist 4.54938 8.23643 6.55187 7.75618 9.74255 14.4867 4.97119 6.41575 11.3136 9.95212 numMergedOcc 0
12 mol 19 unq 6 iso 0 dist 4.54938 7.82528 5.14627 7.75618 9.74255 11.4087 4.97119 6.41575 5.82366 9.95212 numMergedOcc 0
13 mol 19 unq 7 iso 0 dist 4.51865 6.20943 4.69858 8.40416 7.08342 11.4087 4.64838 6.41423 5.82366 9.95212 numMergedOcc 0
14 mol 19 unq 8 iso 0 dist 4.51865 8.58657 6.74265 6.41423 4.64838 5.90856 7.08342 8.40416 7.02548 9.95212 numMergedOcc 0
15 mol 19 unq 9 iso 0 dist 6.864 8.78293 11.4401 7.75618 7.08342 6.2337 4.97119 6.41423 13.1234 9.95212 numMergedOcc 0
16 mol 19 unq 10 iso 0 dist 6.864 8.23643 12.3093 7.75618 7.08342 14.4867 4.97119 6.41423 11.3136 9.95212 numMergedOcc 0
17 mol 19 unq 11 iso 0 dist 6.864 7.82528 4.69858 7.75618 7.08342 11.4087 4.97119 6.41423 5.82366 9.95212 numMergedOcc 0
18 mol 19 unq 12 iso 0 dist 6.864 8.58657 5.5841 6.41423 4.97119 5.90856 7.08342 7.75618 7.02548 9.95212 numMergedOcc 0
19 mol 24 unq 0 iso 0 dist 6.86014 9.75144 5.39241 7.33768 4.32034 5.90981 6.66749 9.41441 13.2857 8.00171 numMergedOcc 0
20 mol 24 unq 1 iso 0 dist 6.86014 9.75144 5.39241 9.01567 8.67951 13.2265 6.66749 9.41441 13.2857 4.2121 numMergedOcc 0
21 mol 24 unq 2 iso 0 dist 6.86014 9.75144 5.39241 7.29868 8.52463 13.719 6.66749 9.41441 13.2857 6.72323 numMergedOcc 0
22 mol 100 unq 0 iso 0 dist 9.60661 6.58204 10.9608 7.01812 5.80144 10.0891 10.6848 14.8081 11.9163 9.5057 numMergedOcc 0
23 mol 100 unq 1 iso 0 dist 7.17106 6.58204 5.01145 7.01812 8.4128 10.0891 10.6848 7.10378 11.9163 9.5057 numMergedOcc 0
24 mol 100 unq 2 iso 0 dist 9.35224 6.58204 5.69137 7.01812 10.0456 10.0891 10.6848 15.2289 11.9163 9.5057 numMergedOcc 0
25 mol 100 unq 3 iso 0 dist 7.47343 7.75343 15.209 8.30845 12.2861 10.0891 15.3454 21.075 11.9163 9.5057 numMergedOcc 0
26 mol 100 unq 4 iso 0 dist 6.65086 7.75343 10.9608 8.30845 5.80144 10.0891 15.3454 14.8081 11.9163 9.5057 numMergedOcc 0
27 mol 100 unq 5 iso 0 dist 6.56369 7.75343 5.69137 8.30845 10.0456 10.0891 15.3454 15.2289 11.9163 9.5057 numMergedOcc 0
28 mol 100 unq 6 iso 0 dist 9.30209 7.75343 9.21622 8.30845 6.70236 10.0891 15.3454 12.6004 11.9163 9.5057 numMergedOcc 0
29 mol 134 unq 0 iso 0 dist 6.54501 8.6355 10.1448 7.80532 7.41674 14.1488 5.71679 7.69991 8.73604 6.40575 numMergedOcc 0
30 mol 134 unq 1 iso 0 dist 6.49416 8.6355 5.41704 7.80532 9.87376 14.1488 5.71679 6.23142 8.73604 6.40575 numMergedOcc 0
31 mol 156 unq 0 iso 0 dist 8.34702 7.36119 11.787 7.30357 10.4977 11.9671 5.81563 13.0658 6.05323 8.21184 numMergedOcc 0
32 mol 156 unq 1 iso 0 dist 8.34702 7.36119 11.787 7.30357 10.4977 11.9671 5.52796 12.7005 9.81983 5.41575 numMergedOcc 0
33 mol 156 unq 2 iso 0 dist 8.34702 7.36119 11.787 8.61587 12.4274 8.69711 5.81563 13.0658 6.05323 5.9976 numMergedOcc 0
34 mol 156 unq 3 iso 0 dist 8.34702 7.36119 11.787 8.61587 12.4274 8.69711 5.52796 12.7005 9.81983 6.86566 numMergedOcc 0
35 mol 156 unq 4 iso 0 dist 7.44554 6.27641 7.29758 9.4013 5.71511 5.05683 5.4555 9.44367 5.81122 8.37434 numMergedOcc 0
36 mol 156 unq 5 iso 0 dist 7.44554 9.36805 6.29785 9.44367 5.4555 10.143 5.71511 9.4013 10.735 8.37434 numMergedOcc 0
37 mol 156 unq 6 iso 0 dist 8.94056 6.27641 8.67156 9.4013 6.13574 5.05683 5.4555 7.90267 5.81122 8.37434 numMergedOcc 0
38 mol 156 unq 7 iso 0 dist 9.83699 6.27641 4.53931 9.4013 5.80008 5.05683 5.4555 10.3379 5.81122 8.37434 numMergedOcc 0
39 mol 156 unq 8 iso 0 dist 9.06726 7.36119 7.71144 7.30357 12.3086 11.9671 5.81563 11.5017 6.05323 8.21184 numMergedOcc 0
40 mol 156 unq 9 iso 0 dist 9.06726 7.36119 7.71144 7.30357 12.3086 11.9671 5.52796 13.258 9.81983 5.41575 numMergedOcc 0
41 mol 156 unq 10 iso 0 dist 9.06726 7.36119 7.71144 8.61587 10.9151 8.69711 5.81563 11.5017 6.05323 5.9976 numMergedOcc 0
42 mol 156 unq 11 iso 0 dist 9.06726 7.36119 7.71144 8.61587 10.9151 8.69711 5.52796 13.258 9.81983 6.86566 numMergedOcc 0
43 mol 156 unq 12 iso 0 dist 8.33171 7.36119 9.22231 7.30357 7.79535 11.9671 5.81563 10.0063 6.05323 8.21184 numMergedOcc 0
44 mol 156 unq 13 iso 0 dist 8.33171 7.36119 9.22231 7.30357 7.79535 11.9671 5.52796 10.5287 9.81983 5.41575 numMergedOcc 0
45 mol 156 unq 14 iso 0 dist 8.33171 7.36119 9.22231 8.61587 6.98125 8.69711 5.81563 10.0063 6.05323 5.9976 numMergedOcc 0
46 mol 156 unq 15 iso 0 dist 8.33171 7.36119 9.22231 8.61587 6.98125 8.69711 5.52796 10.5287 9.81983 6.86566 numMergedOcc 0
47 mol 181 unq 0 iso 0 dist 5.98885 7.20046 5.4601 9.72611 5.6044 9.87435 12.7358 11.602 14.6631 7.22883 numMergedOcc 0
48 mol 181 unq 1 iso 0 dist 5.98885 7.20046 5.4601 7.99195 6.6251 4.69841 12.2164 12.4878 11.913 7.32087 numMergedOcc 0
49 mol 181 unq 2 iso 0 dist 5.98885 7.20046 5.4601 7.99195 6.6251 4.69841 5.77299 10.6908 10.0659 8.86197 numMergedOcc 0
50 mol 181 unq 3 iso 0 dist 5.98885 7.13543 10.0524 9.72611 5.6044 14.6648 12.7358 11.602 17.8119 7.22883 numMergedOcc 0
51 mol 181 unq 4 iso 0 dist 5.98885 7.13543 10.0524 7.99195 6.6251 7.23063 12.2164 12.4878 11.5642 7.32087 numMergedOcc 0
52 mol 181 unq 5 iso 0 dist 5.98885 7.13543 10.0524 7.99195 6.6251 7.23063 5.77299 10.6908 6.32777 8.86197 numMergedOcc 0
53 mol 181 unq 6 iso 0 dist 9.09537 7.20046 6.14208 9.72611 12.9468 9.87435 12.7358 14.8662 14.6631 7.22883 numMergedOcc 0
54 mol 181 unq 7 iso 0 dist 9.09537 7.20046 6.14208 7.99195 10.09 4.69841 12.2164 16.4314 11.913 7.32087 numMergedOcc 0
55 mol 181 unq 8 iso 0 dist 9.09537 7.20046 6.14208 7.99195 10.09 4.69841 5.77299 11.3325 10.0659 8.86197 numMergedOcc 0
56 mol 181 unq 9 iso 0 dist 9.09537 7.13543 5.95965 9.72611 12.9468 14.6648 12.7358 14.8662 17.8119 7.22883 numMergedOcc 0
57 mol 181 unq 10 iso 0 dist 9.09537 7.13543 5.95965 7.99195 10.09 7.23063 12.2164 16.4314 11.5642 7.32087 numMergedOcc 0
58 mol 181 unq 11 iso 0 dist 9.09537 7.13543 5.95965 7.99195 10.09 7.23063 5.77299 11.3325 6.32777 8.86197 numMergedOcc 0
59 mol 181 unq 12 iso 0 dist 7.81386 7.98142 9.53462 5.94469 7.77758 8.93991 9.69409 14.08 17.0683 9.92471 numMergedOcc 0
60 mol 181 unq 13 iso 0 dist 7.81386 7.37327 11.1462 5.94469 7.77758 5.35588 9.69409 14.08 13.2307 9.92471 numMergedOcc 0
61 mol 181 unq 14 iso 0 dist 7.63312 6.93764 4.80231 5.9176 5.63555 5.60306 6.29863 11.9764 9.93639 7.22883 numMergedOcc 0
62 mol 181 unq 15 iso 0 dist 7.63312 7.98142 9.60512 5.94469 12.5387 8.93991 9.69409 15.9489 17.0683 9.92471 numMergedOcc 0
63 mol 181 unq 16 iso 0 dist 7.63312 7.37327 13.3389 5.94469 12.5387 5.35588 9.69409 15.9489 13.2307 9.92471 numMergedOcc 0
64 mol 249 unq 0 iso 0 dist 7.57994 8.83735 5.23473 5.48118 10.7772 10.639 9.0676 16.0282 16.1595 5.9627 numMergedOcc 0
65 mol 249 unq 1 iso 0 dist 6.18582 8.83735 7.38675 5.48118 7.04666 10.639 9.0676 12.4721 16.1595 5.9627 numMergedOcc 0
