0 mol 43 unq 0 iso 0 dist 6.6263 8.13395 6.75943 7.05402 7.15901 5.48048 10.8828 8.34145 5.07458 4.69849 numMergedOcc 0
1 mol 43 unq 0 iso 1 dist 6.75943 8.13395 6.6263 5.48048 7.15901 7.05402 5.07458 8.34145 10.8828 4.69849 numMergedOcc 0
2 mol 89 unq 0 iso 0 dist 8.40422 5.52198 8.40425 8.79802 6.65534 5.88324 10.6632 8.05579 9.32983 4.01045 numMergedOcc 0
3 mol 89 unq 0 iso 1 dist 8.40425 5.52198 8.40422 5.88324 6.65534 8.79802 9.32983 8.05579 10.6632 4.01045 numMergedOcc 0
4 mol 89 unq 1 iso 0 dist 8.40422 9.1532 7.47974 8.79802 6.65534 6.52312 10.6632 8.05579 10.4274 4.01045 numMergedOcc 0
5 mol 89 unq 1 iso 1 dist 7.47974 9.1532 8.40422 6.52312 6.65534 8.79802 10.4274 8.05579 10.6632 4.01045 numMergedOcc 0
6 mol 89 unq 2 iso 0 dist 8.40422 6.50464 5.51831 8.79802 6.65534 6.60299 10.6632 8.05579 6.13636 4.01045 numMergedOcc 0
7 mol 89 unq 2 iso 1 dist 5.51831 6.50464 8.40422 6.60299 6.65534 8.79802 6.13636 8.05579 10.6632 4.01045 numMergedOcc 0
8 mol 89 unq 3 iso 0 dist 8.40422 6.54355 9.65149 8.79802 6.65534 6.30713 10.6632 8.05579 6.14929 4.01045 numMergedOcc 0
9 mol 89 unq 3 iso 1 dist 9.65149 6.54355 8.40422 6.30713 6.65534 8.79802 6.14929 8.05579 10.6632 4.01045 numMergedOcc 0
10 mol 89 unq 1 iso 0 dist 8.40425 4.8812 7.47974 5.88324 6.65534 6.52312 9.32983 8.05579 10.4274 4.01045 numMergedOcc 0
11 mol 89 unq 1 iso 1 dist 7.47974 4.8812 8.40425 6.52312 6.65534 5.88324 10.4274 8.05579 9.32983 4.01045 numMergedOcc 0
12 mol 89 unq 2 iso 0 dist 8.40425 8.46794 5.51831 5.88324 6.65534 6.60299 9.32983 8.05579 6.13636 4.01045 numMergedOcc 0
13 mol 89 unq 2 iso 1 dist 5.51831 8.46794 8.40425 6.60299 6.65534 5.88324 6.13636 8.05579 9.32983 4.01045 numMergedOcc 0
14 mol 89 unq 3 iso 0 dist 8.40425 7.1456 9.65149 5.88324 6.65534 6.30713 9.32983 8.05579 6.14929 4.01045 numMergedOcc 0
15 mol 89 unq 3 iso 1 dist 9.65149 7.1456 8.40425 6.30713 6.65534 5.88324 6.14929 8.05579 9.32983 4.01045 numMergedOcc 0
16 mol 89 unq 2 iso 0 dist 7.47974 10.4087 5.51831 6.52312 6.65534 6.60299 10.4274 8.05579 6.13636 4.01045 numMergedOcc 0
17 mol 89 unq 2 iso 1 dist 5.51831 10.4087 7.47974 6.60299 6.65534 6.52312 6.13636 8.05579 10.4274 4.01045 numMergedOcc 0
18 mol 89 unq 3 iso 0 dist 7.47974 10.8948 9.65149 6.52312 6.65534 6.30713 10.4274 8.05579 6.14929 4.01045 numMergedOcc 0
19 mol 89 unq 3 iso 1 dist 9.65149 10.8948 7.47974 6.30713 6.65534 6.52312 6.14929 8.05579 10.4274 4.01045 numMergedOcc 0
20 mol 89 unq 3 iso 0 dist 5.51831 5.45013 9.65149 6.60299 6.65534 6.30713 6.13636 8.05579 6.14929 4.01045 numMergedOcc 0
21 mol 89 unq 3 iso 1 dist 9.65149 5.45013 5.51831 6.30713 6.65534 6.60299 6.14929 8.05579 6.13636 4.01045 numMergedOcc 0
22 mol 105 unq 0 iso 0 dist 9.16718 5.68291 7.94633 7.33596 7.44838 8.22667 4.4598 9.17843 8.50101 9.94027 numMergedOcc 0
23 mol 105 unq 0 iso 1 dist 7.94633 5.68291 9.16718 8.22667 7.44838 7.33596 8.50101 9.17843 4.4598 9.94027 numMergedOcc 0
24 mol 112 unq 0 iso 0 dist 7.7988 4.97527 9.40824 7.83771 7.34602 11.4843 11.0625 6.96745 14.5726 9.02942 numMergedOcc 0
25 mol 112 unq 0 iso 1 dist 9.40824 4.97527 7.7988 11.4843 7.34602 7.83771 14.5726 6.96745 11.0625 9.02942 numMergedOcc 0
26 mol 112 unq 1 iso 0 dist 7.7988 6.34999 4.22363 7.83771 7.34602 9.97869 11.0625 6.96745 9.05551 9.02942 numMergedOcc 0
27 mol 112 unq 1 iso 1 dist 4.22363 6.34999 7.7988 9.97869 7.34602 7.83771 9.05551 6.96745 11.0625 9.02942 numMergedOcc 0
28 mol 112 unq 1 iso 0 dist 9.40824 6.72751 4.22363 11.4843 7.34602 9.97869 14.5726 6.96745 9.05551 9.02942 numMergedOcc 0
29 mol 112 unq 1 iso 1 dist 4.22363 6.72751 9.40824 9.97869 7.34602 11.4843 9.05551 6.96745 14.5726 9.02942 numMergedOcc 0
30 mol 134 unq 0 iso 0 dist 9.33094 6.81259 8.69531 9.4027 5.11043 5.12325 8.06642 8.62504 4.00092 4.935 numMergedOcc 0
31 mol 134 unq 0 iso 1 dist 8.69531 6.81259 9.33094 5.12325 5.11043 9.4027 4.00092 8.62504 8.06642 4.935 numMergedOcc 0
32 mol 134 unq 1 iso 0 dist 5.35237 6.90348 7.99477 6.02179 8.48313 10.9332 5.4761 5.78982 5.03507 11.1905 numMergedOcc 0
33 mol 134 unq 1 iso 1 dist 7.99477 6.90348 5.35237 10.9332 8.48313 6.02179 5.03507 5.78982 5.4761 11.1905 numMergedOcc 0
34 mol 170 unq 0 iso 0 dist 9.08274 8.56034 9.51256 5.95519 5.13268 7.72147 6.86812 8.75024 5.7304 8.5768 numMergedOcc 0
35 mol 170 unq 0 iso 1 dist 9.51256 8.56034 9.08274 7.72147 5.13268 5.95519 5.7304 8.75024 6.86812 8.5768 numMergedOcc 0
36 mol 227 unq 0 iso 0 dist 5.23634 5.22356 6.91318 10.5813 9.43618 7.22396 4.664 8.85955 8.49509 14.9695 numMergedOcc 0
37 mol 227 unq 0 iso 1 dist 6.91318 5.22356 5.23634 7.22396 9.43618 10.5813 8.49509 8.85955 4.664 14.9695 numMergedOcc 0
38 mol 227 unq 1 iso 0 dist 5.23634 5.22356 6.91318 10.5813 9.43618 7.22396 4.1511 6.09335 4.69247 11.2819 numMergedOcc 0
39 mol 227 unq 1 iso 1 dist 6.91318 5.22356 5.23634 7.22396 9.43618 10.5813 4.69247 6.09335 4.1511 11.2819 numMergedOcc 0
40 mol 235 unq 0 iso 0 dist 8.19317 7.218 5.1823 11.5211 9.11454 6.65703 9.72447 6.03081 4.21867 10.0222 numMergedOcc 0
41 mol 235 unq 0 iso 1 dist 5.1823 7.218 8.19317 6.65703 9.11454 11.5211 4.21867 6.03081 9.72447 10.0222 numMergedOcc 0
42 mol 235 unq 1 iso 0 dist 8.19317 7.218 5.1823 11.5211 9.11454 6.65703 12.983 7.41433 5.88852 6.89973 numMergedOcc 0
43 mol 235 unq 1 iso 1 dist 5.1823 7.218 8.19317 6.65703 9.11454 11.5211 5.88852 7.41433 12.983 6.89973 numMergedOcc 0
44 mol 238 unq 0 iso 0 dist 9.12776 15.7907 9.72188 11.0349 6.53286 10.7551 5.71717 4.66186 10.4706 8.5378 numMergedOcc 0
45 mol 238 unq 0 iso 1 dist 9.72188 15.7907 9.12776 10.7551 6.53286 11.0349 10.4706 4.66186 5.71717 8.5378 numMergedOcc 0
46 mol 264 unq 0 iso 0 dist 5.90924 7.07277 5.90058 4.48907 7.14086 9.09085 5.71153 9.78237 12.6872 5.82131 numMergedOcc 0
47 mol 264 unq 0 iso 1 dist 5.90058 7.07277 5.90924 9.09085 7.14086 4.48907 12.6872 9.78237 5.71153 5.82131 numMergedOcc 0
48 mol 264 unq 1 iso 0 dist 5.90924 7.07277 5.90058 4.48907 7.14086 9.09085 5.70542 9.70101 9.63145 10.0297 numMergedOcc 0
49 mol 264 unq 1 iso 1 dist 5.90058 7.07277 5.90924 9.09085 7.14086 4.48907 9.63145 9.70101 5.70542 10.0297 numMergedOcc 0
50 mol 264 unq 2 iso 0 dist 5.90924 7.07277 5.90058 4.48907 7.14086 9.09085 6.87635 9.95798 12.9337 9.58444 numMergedOcc 0
51 mol 264 unq 2 iso 1 dist 5.90058 7.07277 5.90924 9.09085 7.14086 4.48907 12.9337 9.95798 6.87635 9.58444 numMergedOcc 0
52 mol 264 unq 3 iso 0 dist 5.90924 8.96144 9.58916 4.48907 7.14086 10.1591 5.71153 9.78237 6.56539 5.82131 numMergedOcc 0
53 mol 264 unq 3 iso 1 dist 9.58916 8.96144 5.90924 10.1591 7.14086 4.48907 6.56539 9.78237 5.71153 5.82131 numMergedOcc 0
54 mol 264 unq 4 iso 0 dist 5.90924 8.96144 9.58916 4.48907 7.14086 10.1591 5.70542 9.70101 10.1301 10.0297 numMergedOcc 0
55 mol 264 unq 4 iso 1 dist 9.58916 8.96144 5.90924 10.1591 7.14086 4.48907 10.1301 9.70101 5.70542 10.0297 numMergedOcc 0
56 mol 264 unq 5 iso 0 dist 5.90924 8.96144 9.58916 4.48907 7.14086 10.1591 6.87635 9.95798 4.76241 9.58444 numMergedOcc 0
57 mol 264 unq 5 iso 1 dist 9.58916 8.96144 5.90924 10.1591 7.14086 4.48907 4.76241 9.95798 6.87635 9.58444 numMergedOcc 0
58 mol 264 unq 3 iso 0 dist 5.90058 14.3597 9.58916 9.09085 7.14086 10.1591 12.6872 9.78237 6.56539 5.82131 numMergedOcc 0
59 mol 264 unq 3 iso 1 dist 9.58916 14.3597 5.90058 10.1591 7.14086 9.09085 6.56539 9.78237 12.6872 5.82131 numMergedOcc 0
60 mol 264 unq 4 iso 0 dist 5.90058 14.3597 9.58916 9.09085 7.14086 10.1591 9.63145 9.70101 10.1301 10.0297 numMergedOcc 0
61 mol 264 unq 4 iso 1 dist 9.58916 14.3597 5.90058 10.1591 7.14086 9.09085 10.1301 9.70101 9.63145 10.0297 numMergedOcc 0
62 mol 264 unq 5 iso 0 dist 5.90058 14.3597 9.58916 9.09085 7.14086 10.1591 12.9337 9.95798 4.76241 9.58444 numMergedOcc 0
63 mol 264 unq 5 iso 1 dist 9.58916 14.3597 5.90058 10.1591 7.14086 9.09085 4.76241 9.95798 12.9337 9.58444 numMergedOcc 0
64 mol 264 unq 6 iso 0 dist 9.19754 4.92077 8.29262 6.84156 6.02757 9.37297 11.4167 9.78237 13.2035 7.36132 numMergedOcc 0
65 mol 264 unq 6 iso 1 dist 8.29262 4.92077 9.19754 9.37297 6.02757 6.84156 13.2035 9.78237 11.4167 7.36132 numMergedOcc 0
66 mol 284 unq 0 iso 0 dist 9.19921 5.10183 6.41303 10.8266 8.63754 8.63375 11.7046 9.69019 7.70187 5.54893 numMergedOcc 0
67 mol 284 unq 0 iso 1 dist 6.41303 5.10183 9.19921 8.63375 8.63754 10.8266 7.70187 9.69019 11.7046 5.54893 numMergedOcc 0
